Organoheterocyclic compounds

Organic compounds that consist of ring structures, or cyclic compounds that have atoms of at least two different elements as members of its ring(s).

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3,781 – 3,795 of 219,023 results

3,781

4-Methyl-1,3-oxazole-5-carboxylic acid, 95%, Thermo Scientific™

CAS: 2510-32-9 Molecular Formula: C5H5NO3 Molecular Weight (g/mol): 127.099 InChI Key: ZIXUNDOOBLSXPE-UHFFFAOYSA-N Synonym: 4-methyloxazole-5-carboxylic acid,4-methyl-5-oxazolecarboxylic acid,5-oxazolecarboxylic acid, 4-methyl,4-methyl-oxazole-5-carboxylic acid,ksc205g3h,4-methyl-5-oxazolecarboxylicacid,4-methyl-oxazol-5-carboxylic acid,4-methoxyoxazole-5-carboxylic acid,5-oxazolecarboxylicacid, 4-methyl PubChem CID: 292311 IUPAC Name: 4-methyl-1,3-oxazole-5-carboxylic acid SMILES: CC1=C(OC=N1)C(=O)O

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Specifications

PubChem CID	292311
CAS	2510-32-9
Molecular Weight (g/mol)	127.099
SMILES	CC1=C(OC=N1)C(=O)O
Synonym	4-methyloxazole-5-carboxylic acid,4-methyl-5-oxazolecarboxylic acid,5-oxazolecarboxylic acid, 4-methyl,4-methyl-oxazole-5-carboxylic acid,ksc205g3h,4-methyl-5-oxazolecarboxylicacid,4-methyl-oxazol-5-carboxylic acid,4-methoxyoxazole-5-carboxylic acid,5-oxazolecarboxylicacid, 4-methyl
IUPAC Name	4-methyl-1,3-oxazole-5-carboxylic acid
InChI Key	ZIXUNDOOBLSXPE-UHFFFAOYSA-N
Molecular Formula	C5H5NO3

3,782

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2-Chloro-4-fluoropyridine, 97%

CAS: 34941-91-8 Molecular Formula: C₅H₃ClFN Molecular Weight (g/mol): 131.54 MDL Number: MFCD04039345 InChI Key: FGSAQRJRWCZLOB-UHFFFAOYSA-N Synonym: pyridine, 2-chloro-4-fluoro,2-chloro-4-fluoro pyridine,2-chloro-4-fluoro-pyridine,pubchem6180,acmc-1aft7,2-chlro-4-fluoroxypyridine,ksc222e0n,pyrimidine, 4-chloro-6-fluoro,abbypharma ap-14-5731 PubChem CID: 2782792 IUPAC Name: 2-chloro-4-fluoropyridine SMILES: C1=CN=C(C=C1F)Cl

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Specifications

PubChem CID	2782792
CAS	34941-91-8
Molecular Weight (g/mol)	131.54
MDL Number	MFCD04039345
SMILES	C1=CN=C(C=C1F)Cl
Synonym	pyridine, 2-chloro-4-fluoro,2-chloro-4-fluoro pyridine,2-chloro-4-fluoro-pyridine,pubchem6180,acmc-1aft7,2-chlro-4-fluoroxypyridine,ksc222e0n,pyrimidine, 4-chloro-6-fluoro,abbypharma ap-14-5731
IUPAC Name	2-chloro-4-fluoropyridine
InChI Key	FGSAQRJRWCZLOB-UHFFFAOYSA-N
Molecular Formula	C₅H₃ClFN

3,783

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7-Nitro-1,2,3,4-tetrahydroquinoline, 95%

CAS: 30450-62-5 Molecular Formula: C9H10N2O2 Molecular Weight (g/mol): 178.191 MDL Number: MFCD00496654 InChI Key: WSWMGHRLUYADNA-UHFFFAOYSA-N Synonym: 1,2,3,4-tetrahydro-7-nitroquinoline,7-nitro-1,2,3,4-tetrahydro quinoline,quinoline, 1,2,3,4-tetrahydro-7-nitro,7-nitro-1,2,3,4-tetrahydro-quinoline,pubchem7584,acmc-1aglc,7-nitrotetrahydro-quinoline,7-nitro-1,2,3,4-terahydroquinoline PubChem CID: 252513 IUPAC Name: 7-nitro-1,2,3,4-tetrahydroquinoline SMILES: C1CC2=C(C=C(C=C2)[N+](=O)[O-])NC1

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Specifications

PubChem CID	252513
CAS	30450-62-5
Molecular Weight (g/mol)	178.191
MDL Number	MFCD00496654
SMILES	C1CC2=C(C=C(C=C2)[N+](=O)[O-])NC1
Synonym	1,2,3,4-tetrahydro-7-nitroquinoline,7-nitro-1,2,3,4-tetrahydro quinoline,quinoline, 1,2,3,4-tetrahydro-7-nitro,7-nitro-1,2,3,4-tetrahydro-quinoline,pubchem7584,acmc-1aglc,7-nitrotetrahydro-quinoline,7-nitro-1,2,3,4-terahydroquinoline
IUPAC Name	7-nitro-1,2,3,4-tetrahydroquinoline
InChI Key	WSWMGHRLUYADNA-UHFFFAOYSA-N
Molecular Formula	C9H10N2O2

3,784

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5-Methylpyridine-3-boronic acid, 98%

CAS: 173999-18-3 Molecular Formula: C6H8BNO2 Molecular Weight (g/mol): 136.945 MDL Number: MFCD03428528 InChI Key: REONQWGHSQHTAC-UHFFFAOYSA-N Synonym: 5-methylpyridine-3-boronic acid,5-methyl-3-pyridineboronic acid,5-methylpyridin-3-yl boronic acid,5-methylpyridin-3-yl-3-boronic acid,5-methylpyridine-3-boronicacid,5-methyl-3-pyridyl boronic acid,5-methyl-3-pyridinyl boronic acid,pubchem17082,3-borono-5-methylpyridine,acmc-209e7n PubChem CID: 2762708 IUPAC Name: (5-methylpyridin-3-yl)boronic acid SMILES: B(C1=CC(=CN=C1)C)(O)O

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Specifications

PubChem CID	2762708
CAS	173999-18-3
Molecular Weight (g/mol)	136.945
MDL Number	MFCD03428528
SMILES	B(C1=CC(=CN=C1)C)(O)O
Synonym	5-methylpyridine-3-boronic acid,5-methyl-3-pyridineboronic acid,5-methylpyridin-3-yl boronic acid,5-methylpyridin-3-yl-3-boronic acid,5-methylpyridine-3-boronicacid,5-methyl-3-pyridyl boronic acid,5-methyl-3-pyridinyl boronic acid,pubchem17082,3-borono-5-methylpyridine,acmc-209e7n
IUPAC Name	(5-methylpyridin-3-yl)boronic acid
InChI Key	REONQWGHSQHTAC-UHFFFAOYSA-N
Molecular Formula	C6H8BNO2

3,785

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2,3,3,5-Tetramethylindolenine, 94%

CAS: 25981-82-2 Molecular Formula: C12H15N Molecular Weight (g/mol): 173.26 MDL Number: MFCD03093020 InChI Key: RQVAPBRSUHSDGP-UHFFFAOYSA-N Synonym: 2,3,3,5-tetramethyl-3h-indole,2,3,3,5-tetramethylindolenine,3h-indole, 2,3,3,5-tetramethyl,pubchem2092,2,3,3,5-tetramethyl-3h-indol,2,3,3,5-tetramethyl-3-h-indole,3h-indole,2,3,3,5-tetramethyl,2,3,3,5-tetramethyl-3-hydroindole,2,3,3,5-tetramethyl-3-h indole PubChem CID: 117693 IUPAC Name: 2,3,3,5-tetramethylindole SMILES: CC1=NC2=CC=C(C)C=C2C1(C)C

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Specifications

PubChem CID	117693
CAS	25981-82-2
Molecular Weight (g/mol)	173.26
MDL Number	MFCD03093020
SMILES	CC1=NC2=CC=C(C)C=C2C1(C)C
Synonym	2,3,3,5-tetramethyl-3h-indole,2,3,3,5-tetramethylindolenine,3h-indole, 2,3,3,5-tetramethyl,pubchem2092,2,3,3,5-tetramethyl-3h-indol,2,3,3,5-tetramethyl-3-h-indole,3h-indole,2,3,3,5-tetramethyl,2,3,3,5-tetramethyl-3-hydroindole,2,3,3,5-tetramethyl-3-h indole
IUPAC Name	2,3,3,5-tetramethylindole
InChI Key	RQVAPBRSUHSDGP-UHFFFAOYSA-N
Molecular Formula	C12H15N

3,786

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N-BOC-1,2,3,6-tetrahydropyridine-4-boronic acid pinacol ester, 97%

CAS: 286961-14-6 Molecular Formula: C16H28BNO4 Molecular Weight (g/mol): 309.21 MDL Number: MFCD03840345 InChI Key: VVDCRJGWILREQH-UHFFFAOYSA-N Synonym: n-boc-1,2,5,6-tetrahydropyridine-4-boronic acid pinacol ester,tert-butyl 4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl-5,6-dihydropyridine-1 2h-carboxylate,1-n-boc-4-4,4,5,5-tetramethyl-1,3,2 dioxaborolan-2-yl-3,6-dihydro-2h-pyridine,n-boc-1,2,3,6-tetrahydropyridine-4-boronic acid pinacol ester,tert-butyl 4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl-3,6-dihydro-2h-pyridine-1-carboxylate,tert-butyl 5,6-dihydro-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl pyridine-1 2h-carboxylate,3,6-dihydro-2h-pyridine-1-n-boc-4-boronic acid pinacol ester,n-tert-butoxycarbonyl-1,2,3,6-tetrahydropyridine-4-boronic acid pinacol ester,1-boc-4-4,4,5,5-tetramethyl-1,3,2 dioxaborolan-2-yl-3,6-dihydro-2h-pyridine,tert-butyl 4-tetramethyl-1,3,2-dioxaborolan-2-yl-1,2,3,6-tetrahydropyridine-1-carboxylate PubChem CID: 4642098 IUPAC Name: tert-butyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,6-dihydro-2H-pyridine-1-carboxylate SMILES: CC(C)(C)OC(=O)N1CCC(=CC1)B1OC(C)(C)C(C)(C)O1

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Specifications

PubChem CID	4642098
CAS	286961-14-6
Molecular Weight (g/mol)	309.21
MDL Number	MFCD03840345
SMILES	CC(C)(C)OC(=O)N1CCC(=CC1)B1OC(C)(C)C(C)(C)O1
Synonym	n-boc-1,2,5,6-tetrahydropyridine-4-boronic acid pinacol ester,tert-butyl 4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl-5,6-dihydropyridine-1 2h-carboxylate,1-n-boc-4-4,4,5,5-tetramethyl-1,3,2 dioxaborolan-2-yl-3,6-dihydro-2h-pyridine,n-boc-1,2,3,6-tetrahydropyridine-4-boronic acid pinacol ester,tert-butyl 4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl-3,6-dihydro-2h-pyridine-1-carboxylate,tert-butyl 5,6-dihydro-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl pyridine-1 2h-carboxylate,3,6-dihydro-2h-pyridine-1-n-boc-4-boronic acid pinacol ester,n-tert-butoxycarbonyl-1,2,3,6-tetrahydropyridine-4-boronic acid pinacol ester,1-boc-4-4,4,5,5-tetramethyl-1,3,2 dioxaborolan-2-yl-3,6-dihydro-2h-pyridine,tert-butyl 4-tetramethyl-1,3,2-dioxaborolan-2-yl-1,2,3,6-tetrahydropyridine-1-carboxylate
IUPAC Name	tert-butyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,6-dihydro-2H-pyridine-1-carboxylate
InChI Key	VVDCRJGWILREQH-UHFFFAOYSA-N
Molecular Formula	C16H28BNO4

3,787

6-(2,2,2-Trifluoroethoxy)nicotinic acid, ≥95%, Thermo Scientific™

CAS: 175204-90-7 Molecular Formula: C8H6F3NO3 Molecular Weight (g/mol): 221.135 MDL Number: MFCD00110708 InChI Key: GZOOLXWQKURRPU-UHFFFAOYSA-N Synonym: 6-2,2,2-trifluoroethoxy nicotinic acid,6-2,2,2-trifluoroethoxy pyridine-3-carboxylic acid,2-trifluoroethoxy pyridine-5-carboxylic acid,3-pyridinecarboxylic acid, 6-2,2,2-trifluoroethoxy,6-2,2,2-trifluoro-ethoxy-nicotinic acid,3-pyridinecarboxylicacid, 6-2,2,2-trifluoroethoxy,maybridge3_005082,pubchem17425,6-2,2,2 trifluroethoxy nicotinic acid,6-2,2,2 trifluoroethoxy nicotinic acid PubChem CID: 2781028 IUPAC Name: 6-(2,2,2-trifluoroethoxy)pyridine-3-carboxylic acid SMILES: C1=CC(=NC=C1C(=O)O)OCC(F)(F)F

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Specifications

PubChem CID	2781028
CAS	175204-90-7
Molecular Weight (g/mol)	221.135
MDL Number	MFCD00110708
SMILES	C1=CC(=NC=C1C(=O)O)OCC(F)(F)F
Synonym	6-2,2,2-trifluoroethoxy nicotinic acid,6-2,2,2-trifluoroethoxy pyridine-3-carboxylic acid,2-trifluoroethoxy pyridine-5-carboxylic acid,3-pyridinecarboxylic acid, 6-2,2,2-trifluoroethoxy,6-2,2,2-trifluoro-ethoxy-nicotinic acid,3-pyridinecarboxylicacid, 6-2,2,2-trifluoroethoxy,maybridge3_005082,pubchem17425,6-2,2,2 trifluroethoxy nicotinic acid,6-2,2,2 trifluoroethoxy nicotinic acid
IUPAC Name	6-(2,2,2-trifluoroethoxy)pyridine-3-carboxylic acid
InChI Key	GZOOLXWQKURRPU-UHFFFAOYSA-N
Molecular Formula	C8H6F3NO3

3,788

1-(1-Benzothiophen-2-yl)-2-bromo-1-ethanone, ≥97%, Thermo Scientific™

CAS: 97511-06-3 Molecular Formula: C10H7BrOS Molecular Weight (g/mol): 255.13 MDL Number: MFCD06658971 InChI Key: WVTSOGFICBVCRE-UHFFFAOYSA-N Synonym: 1-1-benzothiophen-2-yl-2-bromo-1-ethanone,1-1-benzothiophen-2-yl-2-bromoethanone,2-bromoacetyl benzo b thiophene,1-1-benzothiophen-2-yl-2-bromoethan-1-one,1-benzo b thiophen-2-yl-2-bromoethanone,1-benzo b thiophen-2-yl-2-bromoethan-1-one,1-benzothiophen-2-yl-2-bromoethan-1-one,2-bromoacetyl thianaphthene PubChem CID: 2795258 IUPAC Name: 1-(1-benzothiophen-2-yl)-2-bromoethanone SMILES: BrCC(=O)C1=CC2=CC=CC=C2S1

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Specifications

PubChem CID	2795258
CAS	97511-06-3
Molecular Weight (g/mol)	255.13
MDL Number	MFCD06658971
SMILES	BrCC(=O)C1=CC2=CC=CC=C2S1
Synonym	1-1-benzothiophen-2-yl-2-bromo-1-ethanone,1-1-benzothiophen-2-yl-2-bromoethanone,2-bromoacetyl benzo b thiophene,1-1-benzothiophen-2-yl-2-bromoethan-1-one,1-benzo b thiophen-2-yl-2-bromoethanone,1-benzo b thiophen-2-yl-2-bromoethan-1-one,1-benzothiophen-2-yl-2-bromoethan-1-one,2-bromoacetyl thianaphthene
IUPAC Name	1-(1-benzothiophen-2-yl)-2-bromoethanone
InChI Key	WVTSOGFICBVCRE-UHFFFAOYSA-N
Molecular Formula	C10H7BrOS

3,789

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5-Formyl-2,4-dimethylpyrrole-3-carboxylic acid, 96%

CAS: 253870-02-9 Molecular Formula: C8H9NO3 Molecular Weight (g/mol): 167.164 MDL Number: MFCD06202342 InChI Key: YCIHQDVIAISDPS-UHFFFAOYSA-N Synonym: 5-formyl-2,4-dimethylpyrrole-3-carboxylic acid,2,4-dimethyl-5-formylpyrrole-3-carboxylic acid,3,5-dimethyl-2-formylpyrrole-4-carboxylic acid,1h-pyrrole-3-carboxylic acid, 5-formyl-2,4-dimethyl,5-formyl-2,4-dimethyl-1h-pyrrole-3-carboxylicacid,3,5-dimethyl-2-formyl-1h-pyrrole-4-carboxylic acid,3,5-dimethyl-2-formylindole-4-carboxylic acid,zlchem 714,pubchem9414,acmc-209zxq PubChem CID: 11073792 IUPAC Name: 5-formyl-2,4-dimethyl-1H-pyrrole-3-carboxylic acid SMILES: CC1=C(NC(=C1C(=O)O)C)C=O

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Specifications

PubChem CID	11073792
CAS	253870-02-9
Molecular Weight (g/mol)	167.164
MDL Number	MFCD06202342
SMILES	CC1=C(NC(=C1C(=O)O)C)C=O
Synonym	5-formyl-2,4-dimethylpyrrole-3-carboxylic acid,2,4-dimethyl-5-formylpyrrole-3-carboxylic acid,3,5-dimethyl-2-formylpyrrole-4-carboxylic acid,1h-pyrrole-3-carboxylic acid, 5-formyl-2,4-dimethyl,5-formyl-2,4-dimethyl-1h-pyrrole-3-carboxylicacid,3,5-dimethyl-2-formyl-1h-pyrrole-4-carboxylic acid,3,5-dimethyl-2-formylindole-4-carboxylic acid,zlchem 714,pubchem9414,acmc-209zxq
IUPAC Name	5-formyl-2,4-dimethyl-1H-pyrrole-3-carboxylic acid
InChI Key	YCIHQDVIAISDPS-UHFFFAOYSA-N
Molecular Formula	C8H9NO3

3,790

4-(Piperidin-1-ylmethyl)benzonitrile, ≥97%, Thermo Scientific™

CAS: 727733-92-8 Molecular Formula: C13H16N2 Molecular Weight (g/mol): 200.285 MDL Number: MFCD06796182 InChI Key: JOGVBKNLRQCYKS-UHFFFAOYSA-N Synonym: 4-piperidin-1-ylmethyl benzonitrile,1-4-cyanobenzyl piperidine,4-piperidinomethyl benzonitrile,4-piperidylmethyl benzenecarbonitrile,4-piperidin-1-ylmethyl-benzonitrile,benzonitrile,4-1-piperidinylmethyl PubChem CID: 7537603 IUPAC Name: 4-(piperidin-1-ylmethyl)benzonitrile SMILES: C1CCN(CC1)CC2=CC=C(C=C2)C#N

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Specifications

PubChem CID	7537603
CAS	727733-92-8
Molecular Weight (g/mol)	200.285
MDL Number	MFCD06796182
SMILES	C1CCN(CC1)CC2=CC=C(C=C2)C#N
Synonym	4-piperidin-1-ylmethyl benzonitrile,1-4-cyanobenzyl piperidine,4-piperidinomethyl benzonitrile,4-piperidylmethyl benzenecarbonitrile,4-piperidin-1-ylmethyl-benzonitrile,benzonitrile,4-1-piperidinylmethyl
IUPAC Name	4-(piperidin-1-ylmethyl)benzonitrile
InChI Key	JOGVBKNLRQCYKS-UHFFFAOYSA-N
Molecular Formula	C13H16N2

3,791

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5-Amino-3-methyl-1-phenyl-1H-pyrazole, ≥99%, Thermo Scientific Chemicals

CAS: 1131-18-6 Molecular Formula: C10H11N3 Molecular Weight (g/mol): 173.219 MDL Number: MFCD00020727 InChI Key: FMKMKBLHMONXJM-UHFFFAOYSA-N Synonym: 3-methyl-1-phenyl-1h-pyrazol-5-amine,5-amino-3-methyl-1-phenylpyrazole,1h-pyrazol-5-amine, 3-methyl-1-phenyl,1-phenyl-3-methyl-5-aminopyrazole,3-methyl-1-phenylpyrazol-5-ylamine,5-methyl-2-phenyl-2h-pyrazol-3-ylamine,1-phenyl-3-methyl-5-amino pyrazole,unii-x6087geb2p,pyrazole, 5-amino-3-methyl-1-phenyl,1h-pyrazole-5-amine, 3-methyl-1-phenyl PubChem CID: 70801 IUPAC Name: 5-methyl-2-phenylpyrazol-3-amine SMILES: CC1=NN(C(=C1)N)C2=CC=CC=C2

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Specifications

PubChem CID	70801
CAS	1131-18-6
Molecular Weight (g/mol)	173.219
MDL Number	MFCD00020727
SMILES	CC1=NN(C(=C1)N)C2=CC=CC=C2
Synonym	3-methyl-1-phenyl-1h-pyrazol-5-amine,5-amino-3-methyl-1-phenylpyrazole,1h-pyrazol-5-amine, 3-methyl-1-phenyl,1-phenyl-3-methyl-5-aminopyrazole,3-methyl-1-phenylpyrazol-5-ylamine,5-methyl-2-phenyl-2h-pyrazol-3-ylamine,1-phenyl-3-methyl-5-amino pyrazole,unii-x6087geb2p,pyrazole, 5-amino-3-methyl-1-phenyl,1h-pyrazole-5-amine, 3-methyl-1-phenyl
IUPAC Name	5-methyl-2-phenylpyrazol-3-amine
InChI Key	FMKMKBLHMONXJM-UHFFFAOYSA-N
Molecular Formula	C10H11N3

3,792

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4-Nitrobenzeneboronic acid pinacol ester, 98%

CAS: 171364-83-3 Molecular Formula: C12H16BNO4 Molecular Weight (g/mol): 249.073 MDL Number: MFCD02179437 InChI Key: LUWACRUAJXZANC-UHFFFAOYSA-N Synonym: 4,4,5,5-tetramethyl-2-4-nitrophenyl-1,3,2-dioxaborolane,4-nitrophenylboronic acid pinacol ester,4-nitrophenylboronic acid, pinacol ester,4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl nitrobenzene,4-nitrophenyl boronic acid, pinacol ester,1,3,2-dioxaborolane, 4,4,5,5-tetramethyl-2-4-nitrophenyl,pubchem8088,pinacol 4-nitrophenyl boronate;,4-nitrophenylboronate pinacol ester;,para-nitrobenzeneboronic acid pinacol ester; PubChem CID: 2773555 IUPAC Name: 4,4,5,5-tetramethyl-2-(4-nitrophenyl)-1,3,2-dioxaborolane SMILES: B1(OC(C(O1)(C)C)(C)C)C2=CC=C(C=C2)[N+](=O)[O-]

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Specifications

PubChem CID	2773555
CAS	171364-83-3
Molecular Weight (g/mol)	249.073
MDL Number	MFCD02179437
SMILES	B1(OC(C(O1)(C)C)(C)C)C2=CC=C(C=C2)[N+](=O)[O-]
Synonym	4,4,5,5-tetramethyl-2-4-nitrophenyl-1,3,2-dioxaborolane,4-nitrophenylboronic acid pinacol ester,4-nitrophenylboronic acid, pinacol ester,4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl nitrobenzene,4-nitrophenyl boronic acid, pinacol ester,1,3,2-dioxaborolane, 4,4,5,5-tetramethyl-2-4-nitrophenyl,pubchem8088,pinacol 4-nitrophenyl boronate;,4-nitrophenylboronate pinacol ester;,para-nitrobenzeneboronic acid pinacol ester;
IUPAC Name	4,4,5,5-tetramethyl-2-(4-nitrophenyl)-1,3,2-dioxaborolane
InChI Key	LUWACRUAJXZANC-UHFFFAOYSA-N
Molecular Formula	C12H16BNO4

3,793

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3,4-(Methylenedioxy)phenylglyoxal hydrate, 97%, dry wt basis

CAS: 65709-23-1 Molecular Formula: C9H6O4 Molecular Weight (g/mol): 178.14 MDL Number: MFCD03411518 InChI Key: OUCBKIWZWGSDJL-UHFFFAOYSA-N Synonym: 3,4-methylenedioxyphenylglyoxal hydrate,2-benzo d 1,3 dioxol-5-yl-2-oxoacetaldehyde hydrate,3,4-methylenedioxy phenylglyoxal hydrate,2-2h-1,3-benzodioxol-5-yl-2-oxoacetaldehyde hydrate,pubchem12143,benzo d 1,3 dioxole-5-glyoxal hydrate,2-1,3-benzodioxol-5-yl-2-oxoacetaldehyde hydrate,2-1,3-benzodioxol-5-yl-2-oxidanylidene-ethanal hydrate,2-2h-benzo 3,4-d 1,3-dioxolan-5-yl-2-oxoethanal, hydrate PubChem CID: 15608490 IUPAC Name: 2-(1,3-benzodioxol-5-yl)-2-oxoacetaldehyde;hydrate SMILES: O=CC(=O)C1=CC2=C(OCO2)C=C1

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Specifications

PubChem CID	15608490
CAS	65709-23-1
Molecular Weight (g/mol)	178.14
MDL Number	MFCD03411518
SMILES	O=CC(=O)C1=CC2=C(OCO2)C=C1
Synonym	3,4-methylenedioxyphenylglyoxal hydrate,2-benzo d 1,3 dioxol-5-yl-2-oxoacetaldehyde hydrate,3,4-methylenedioxy phenylglyoxal hydrate,2-2h-1,3-benzodioxol-5-yl-2-oxoacetaldehyde hydrate,pubchem12143,benzo d 1,3 dioxole-5-glyoxal hydrate,2-1,3-benzodioxol-5-yl-2-oxoacetaldehyde hydrate,2-1,3-benzodioxol-5-yl-2-oxidanylidene-ethanal hydrate,2-2h-benzo 3,4-d 1,3-dioxolan-5-yl-2-oxoethanal, hydrate
IUPAC Name	2-(1,3-benzodioxol-5-yl)-2-oxoacetaldehyde;hydrate
InChI Key	OUCBKIWZWGSDJL-UHFFFAOYSA-N
Molecular Formula	C9H6O4

3,794

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2-Oxa-5-azaspiro[3.4]octane oxalate, 96%

CAS: 1389264-18-9 Molecular Formula: C8H13NO5 Molecular Weight (g/mol): 203.194 MDL Number: MFCD18325162 InChI Key: JFOZNINEJYPQQK-UHFFFAOYSA-N Synonym: 2-oxa-5-azaspiro 3.4 octane oxalate,2-oxa-5-aza-spiro 3.4 octane oxalate,2-oxa-5-azaspiro 3.4 octane oxalate salt,2-oxa-5-azaspiro 3.4 octane, hemioxalate salt,2-oxa-5-azaspiro 3.4 octane; oxalic acid PubChem CID: 72207353 IUPAC Name: 2-oxa-5-azaspiro[3.4]octane;oxalic acid SMILES: C1CC2(COC2)NC1.C(=O)(C(=O)O)O

Pricing & Availability
Specifications

PubChem CID	72207353
CAS	1389264-18-9
Molecular Weight (g/mol)	203.194
MDL Number	MFCD18325162
SMILES	C1CC2(COC2)NC1.C(=O)(C(=O)O)O
Synonym	2-oxa-5-azaspiro 3.4 octane oxalate,2-oxa-5-aza-spiro 3.4 octane oxalate,2-oxa-5-azaspiro 3.4 octane oxalate salt,2-oxa-5-azaspiro 3.4 octane, hemioxalate salt,2-oxa-5-azaspiro 3.4 octane; oxalic acid
IUPAC Name	2-oxa-5-azaspiro[3.4]octane;oxalic acid
InChI Key	JFOZNINEJYPQQK-UHFFFAOYSA-N
Molecular Formula	C8H13NO5

3,795

tert-Butyl 4-(3-aminobenzyl)piperazine-1-carboxylate, 97%, Thermo Scientific™

CAS: 361345-40-6 Molecular Formula: C16H25N3O2 Molecular Weight (g/mol): 291.395 InChI Key: VKSINZNBWVJILC-UHFFFAOYSA-N Synonym: tert-butyl 4-3-aminobenzyl piperazine-1-carboxylate,1-boc-4-3-aminobenzyl piperazine,3-4-boc-piperazin-1-yl-methyl aniline,tert-butyl 4-3-aminophenyl methyl piperazine-1-carboxylate,3-1-boc-piperazin-4-yl-methyl-aniline,tert-butyl 4-3-aminophenyl methyl piperazinecarboxylate,4-3-amino-benzyl-piperazine-1-carboxylic acid tert-butyl ester,pubchem12209,acmc-1ah36,4-3-aminobenzyl piperazine, n1-boc protected PubChem CID: 7127799 IUPAC Name: tert-butyl 4-[(3-aminophenyl)methyl]piperazine-1-carboxylate SMILES: CC(C)(C)OC(=O)N1CCN(CC1)CC2=CC(=CC=C2)N

Pricing & Availability
Specifications

PubChem CID	7127799
CAS	361345-40-6
Molecular Weight (g/mol)	291.395
SMILES	CC(C)(C)OC(=O)N1CCN(CC1)CC2=CC(=CC=C2)N
Synonym	tert-butyl 4-3-aminobenzyl piperazine-1-carboxylate,1-boc-4-3-aminobenzyl piperazine,3-4-boc-piperazin-1-yl-methyl aniline,tert-butyl 4-3-aminophenyl methyl piperazine-1-carboxylate,3-1-boc-piperazin-4-yl-methyl-aniline,tert-butyl 4-3-aminophenyl methyl piperazinecarboxylate,4-3-amino-benzyl-piperazine-1-carboxylic acid tert-butyl ester,pubchem12209,acmc-1ah36,4-3-aminobenzyl piperazine, n1-boc protected
IUPAC Name	tert-butyl 4-[(3-aminophenyl)methyl]piperazine-1-carboxylate
InChI Key	VKSINZNBWVJILC-UHFFFAOYSA-N
Molecular Formula	C16H25N3O2

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