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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3,916 – 3,930 of 268,062 results

3,916

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6-Chloro-1,3-dimethyluracil, 97%

CAS: 6972-27-6 Molecular Formula: C6H7ClN2O2 Molecular Weight (g/mol): 174.58 MDL Number: MFCD00038066 InChI Key: VATQPUHLFQHDBD-UHFFFAOYSA-N Synonym: 6-chloro-1,3-dimethyluracil,6-chloro-1,3-dimethylpyrimidine-2,4 1h,3h-dione,1,3-dimethyl-6-chlorouracil,6-chloro-1,3-dimethyl-2,4 1h,3h-pyrimidinedione,2,4 1h,3h-pyrimidinedione, 6-chloro-1,3-dimethyl,6-chloro-2,4-dihydroxy-1,3-dimethylpyrimidine,6-chloro-1,3-dimethyl-2,4-1h,3h-pyrimidinedione,6-chloro-1,3-dimethyl-1,3-dihydropyrimidine-2,4-dione,acmc-209oan,1,3-dimethyl-4-chlorouracil PubChem CID: 81442 IUPAC Name: 6-chloro-1,3-dimethylpyrimidine-2,4-dione SMILES: CN1C(Cl)=CC(=O)N(C)C1=O

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Specifications

PubChem CID	81442
CAS	6972-27-6
Molecular Weight (g/mol)	174.58
MDL Number	MFCD00038066
SMILES	CN1C(Cl)=CC(=O)N(C)C1=O
Synonym	6-chloro-1,3-dimethyluracil,6-chloro-1,3-dimethylpyrimidine-2,4 1h,3h-dione,1,3-dimethyl-6-chlorouracil,6-chloro-1,3-dimethyl-2,4 1h,3h-pyrimidinedione,2,4 1h,3h-pyrimidinedione, 6-chloro-1,3-dimethyl,6-chloro-2,4-dihydroxy-1,3-dimethylpyrimidine,6-chloro-1,3-dimethyl-2,4-1h,3h-pyrimidinedione,6-chloro-1,3-dimethyl-1,3-dihydropyrimidine-2,4-dione,acmc-209oan,1,3-dimethyl-4-chlorouracil
IUPAC Name	6-chloro-1,3-dimethylpyrimidine-2,4-dione
InChI Key	VATQPUHLFQHDBD-UHFFFAOYSA-N
Molecular Formula	C6H7ClN2O2

3,917

Isonipecotic acid, 98%

CAS: 498-94-2 Molecular Formula: C6H11NO2 Molecular Weight (g/mol): 129.16 MDL Number: MFCD00006004 InChI Key: SRJOCJYGOFTFLH-UHFFFAOYSA-N Synonym: isonipecotic acid,4-piperidinecarboxylic acid,4-carboxypiperidine,hexahydroisonicotinic acid,dl-isopipecolinic acid,isonicotinic acid, hexahydro,h-inp-oh,acide isonipecotique,4-hexahydroisonicotinic acid,unii-m5tzp1rwie PubChem CID: 3773 IUPAC Name: piperidine-4-carboxylic acid SMILES: OC(=O)C1CCNCC1

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Specifications

PubChem CID	3773
CAS	498-94-2
Molecular Weight (g/mol)	129.16
MDL Number	MFCD00006004
SMILES	OC(=O)C1CCNCC1
Synonym	isonipecotic acid,4-piperidinecarboxylic acid,4-carboxypiperidine,hexahydroisonicotinic acid,dl-isopipecolinic acid,isonicotinic acid, hexahydro,h-inp-oh,acide isonipecotique,4-hexahydroisonicotinic acid,unii-m5tzp1rwie
IUPAC Name	piperidine-4-carboxylic acid
InChI Key	SRJOCJYGOFTFLH-UHFFFAOYSA-N
Molecular Formula	C6H11NO2

3,918

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Benzo[b]thiophene-2-carboxylic acid, 98%

CAS: 6314-28-9 Molecular Formula: C9H6O2S Molecular Weight (g/mol): 178.21 MDL Number: MFCD00051636 InChI Key: DYSJMQABFPKAQM-UHFFFAOYSA-N Synonym: benzo b thiophene-2-carboxylic acid,thianaphthene-2-carboxylic acid,thionaphthene-2-carboxylic acid,tnca,benzothiophene-2-carboxylic acid,2-benzo b thiophenecarboxylic acid,unii-hlr49221fq,thionapthene-2-carboxylic acid,thianaphthene-2-carboxylicacid PubChem CID: 95864 IUPAC Name: 1-benzothiophene-2-carboxylic acid SMILES: OC(=O)C1=CC2=CC=CC=C2S1

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Specifications

PubChem CID	95864
CAS	6314-28-9
Molecular Weight (g/mol)	178.21
MDL Number	MFCD00051636
SMILES	OC(=O)C1=CC2=CC=CC=C2S1
Synonym	benzo b thiophene-2-carboxylic acid,thianaphthene-2-carboxylic acid,thionaphthene-2-carboxylic acid,tnca,benzothiophene-2-carboxylic acid,2-benzo b thiophenecarboxylic acid,unii-hlr49221fq,thionapthene-2-carboxylic acid,thianaphthene-2-carboxylicacid
IUPAC Name	1-benzothiophene-2-carboxylic acid
InChI Key	DYSJMQABFPKAQM-UHFFFAOYSA-N
Molecular Formula	C9H6O2S

3,919

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2-Mercapto-1-methylimidazole, 98%

CAS: 60-56-0 Molecular Formula: C4H6N2S Molecular Weight (g/mol): 114.17 MDL Number: MFCD00179321 InChI Key: PMRYVIKBURPHAH-UHFFFAOYSA-N Synonym: methimazole,thiamazole,2-mercapto-1-methylimidazole,tapazole,mercazolyl,1-methylimidazole-2-thiol,mercazole,metazolo,methimazol,thiamazol PubChem CID: 1349907 ChEBI: CHEBI:50673 IUPAC Name: 3-methyl-1H-imidazole-2-thione SMILES: CN1C=CNC1=S

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Specifications

PubChem CID	1349907
CAS	60-56-0
Molecular Weight (g/mol)	114.17
ChEBI	CHEBI:50673
MDL Number	MFCD00179321
SMILES	CN1C=CNC1=S
Synonym	methimazole,thiamazole,2-mercapto-1-methylimidazole,tapazole,mercazolyl,1-methylimidazole-2-thiol,mercazole,metazolo,methimazol,thiamazol
IUPAC Name	3-methyl-1H-imidazole-2-thione
InChI Key	PMRYVIKBURPHAH-UHFFFAOYSA-N
Molecular Formula	C4H6N2S

3,920

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Maleimide, 98+%

CAS: 541-59-3 Molecular Formula: C8H4AgKN2O4 Molecular Weight (g/mol): 339.10 MDL Number: MFCD00005494 InChI Key: KWLWLQRUFFGWNG-UHFFFAOYSA-L Synonym: maleimide,1h-pyrrole-2,5-dione,2,5-pyrroledione,maleinimide,maleic imide,3-pyrroline-2,5-dione,2,5-dihydro-1h-pyrrole-2,5-dione,unii-2519r1ugp8,ccris 3408,5-hydroxy-2h-pyrrol-2-one PubChem CID: 10935 ChEBI: CHEBI:16072 IUPAC Name: pyrrole-2,5-dione SMILES: [K+].[Ag+].O=C1[N-]C(=O)C=C1.O=C1[N-]C(=O)C=C1

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Specifications

PubChem CID	10935
CAS	541-59-3
Molecular Weight (g/mol)	339.10
ChEBI	CHEBI:16072
MDL Number	MFCD00005494
SMILES	[K+].[Ag+].O=C1[N-]C(=O)C=C1.O=C1[N-]C(=O)C=C1
Synonym	maleimide,1h-pyrrole-2,5-dione,2,5-pyrroledione,maleinimide,maleic imide,3-pyrroline-2,5-dione,2,5-dihydro-1h-pyrrole-2,5-dione,unii-2519r1ugp8,ccris 3408,5-hydroxy-2h-pyrrol-2-one
IUPAC Name	pyrrole-2,5-dione
InChI Key	KWLWLQRUFFGWNG-UHFFFAOYSA-L
Molecular Formula	C8H4AgKN2O4

3,921

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3-Methylthiophene, 98+%

CAS: 616-44-4 Molecular Formula: C5H6S Molecular Weight (g/mol): 98.163 MDL Number: MFCD00005470 InChI Key: QENGPZGAWFQWCZ-UHFFFAOYSA-N Synonym: thiophene, 3-methyl,3-thiotolene,beta-methylthiophene,poly,p3mt,3-methyl thiophene,3-methyl-thiophene,methyl-3-thiophene,ccris 2937,thiophene, 3-methyl-, homopolymer PubChem CID: 12024 IUPAC Name: 3-methylthiophene SMILES: CC1=CSC=C1

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Specifications

PubChem CID	12024
CAS	616-44-4
Molecular Weight (g/mol)	98.163
MDL Number	MFCD00005470
SMILES	CC1=CSC=C1
Synonym	thiophene, 3-methyl,3-thiotolene,beta-methylthiophene,poly,p3mt,3-methyl thiophene,3-methyl-thiophene,methyl-3-thiophene,ccris 2937,thiophene, 3-methyl-, homopolymer
IUPAC Name	3-methylthiophene
InChI Key	QENGPZGAWFQWCZ-UHFFFAOYSA-N
Molecular Formula	C5H6S

3,922

5-Methyl-4-isoxazolecarbonyl chloride, 97%, Thermo Scientific™

CAS: 67305-24-2 Molecular Formula: C5H4ClNO2 Molecular Weight (g/mol): 145.542 InChI Key: ZKAQPVQEYCFRTK-UHFFFAOYSA-N Synonym: 5-methyl-4-isoxazolecarbonyl chloride,5-methylisoxazole-4-carbonyl chloride,5-methyl-4-isoxazolecarbonylchloride,4-isoxazolecarbonyl chloride, 5-methyl,4-isoxazolecarbonylchloride, 5-methyl,5-methyl-isoxazole-4-carbonyl chloride,acmc-209nyg,methyl-4-isoxazolecarbonyl chloride,4-isoxazolecarbonylchloride,5-methyl PubChem CID: 2759917 IUPAC Name: 5-methyl-1,2-oxazole-4-carbonyl chloride SMILES: CC1=C(C=NO1)C(=O)Cl

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Specifications

PubChem CID	2759917
CAS	67305-24-2
Molecular Weight (g/mol)	145.542
SMILES	CC1=C(C=NO1)C(=O)Cl
Synonym	5-methyl-4-isoxazolecarbonyl chloride,5-methylisoxazole-4-carbonyl chloride,5-methyl-4-isoxazolecarbonylchloride,4-isoxazolecarbonyl chloride, 5-methyl,4-isoxazolecarbonylchloride, 5-methyl,5-methyl-isoxazole-4-carbonyl chloride,acmc-209nyg,methyl-4-isoxazolecarbonyl chloride,4-isoxazolecarbonylchloride,5-methyl
IUPAC Name	5-methyl-1,2-oxazole-4-carbonyl chloride
InChI Key	ZKAQPVQEYCFRTK-UHFFFAOYSA-N
Molecular Formula	C5H4ClNO2

3,923

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2-Amino-6-chloropyridine, 97%

CAS: 45644-21-1 Molecular Formula: C₅H₅ClN₂ Molecular Weight (g/mol): 128.56 MDL Number: MFCD00234068 InChI Key: OBYJTLDIQBWBHM-UHFFFAOYSA-N Synonym: 2-amino-6-chloropyridine,2-chloro-6-aminopyridine,2-pyridinamine, 6-chloro,6-chloro-2-pyridinamine,6-chloro-pyridin-2-ylamine,pyridine, 2-amino-6-chloro,6-chloropyridin-2-ylamine,6-chloro-2-pyridylamine,6-amino-2-chloropyridine,2-amino-6-chloropyridine 6-chloropyridin-2-ylamine PubChem CID: 206246 IUPAC Name: 6-chloropyridin-2-amine SMILES: C1=CC(=NC(=C1)Cl)N

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Specifications

PubChem CID	206246
CAS	45644-21-1
Molecular Weight (g/mol)	128.56
MDL Number	MFCD00234068
SMILES	C1=CC(=NC(=C1)Cl)N
Synonym	2-amino-6-chloropyridine,2-chloro-6-aminopyridine,2-pyridinamine, 6-chloro,6-chloro-2-pyridinamine,6-chloro-pyridin-2-ylamine,pyridine, 2-amino-6-chloro,6-chloropyridin-2-ylamine,6-chloro-2-pyridylamine,6-amino-2-chloropyridine,2-amino-6-chloropyridine 6-chloropyridin-2-ylamine
IUPAC Name	6-chloropyridin-2-amine
InChI Key	OBYJTLDIQBWBHM-UHFFFAOYSA-N
Molecular Formula	C₅H₅ClN₂

3,924

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4,7-Phenanthroline, 98%

CAS: 230-07-9 Molecular Formula: C₁₂H₈N₂ Molecular Weight (g/mol): 180.21 MDL Number: MFCD00004987 InChI Key: DATYUTWESAKQQM-UHFFFAOYSA-N Synonym: 4,7 phenanthroline,pyridino 3,2-f quinoline,acmc-1conx,4,7-phenanthroline,bidd:gt0447,chembl81429 PubChem CID: 67472 ChEBI: CHEBI:36419 IUPAC Name: 4,7-phenanthroline SMILES: C1=CC2=C(C=CC3=C2C=CC=N3)N=C1

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Specifications

PubChem CID	67472
CAS	230-07-9
Molecular Weight (g/mol)	180.21
ChEBI	CHEBI:36419
MDL Number	MFCD00004987
SMILES	C1=CC2=C(C=CC3=C2C=CC=N3)N=C1
Synonym	4,7 phenanthroline,pyridino 3,2-f quinoline,acmc-1conx,4,7-phenanthroline,bidd:gt0447,chembl81429
IUPAC Name	4,7-phenanthroline
InChI Key	DATYUTWESAKQQM-UHFFFAOYSA-N
Molecular Formula	C₁₂H₈N₂

3,925

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3-Methyl-1-phenyl-1H-pyrazole, 98%, Thermo Scientific™

CAS: 1128-54-7 Molecular Formula: C10H10N2 Molecular Weight (g/mol): 158.20 MDL Number: MFCD00003123 InChI Key: RJXLUGSJEMSDPK-UHFFFAOYSA-N Synonym: 3-methyl-1-phenyl-1h-pyrazole,1-phenyl-3-methylpyrazole,pyrazole, 3-methyl-1-phenyl,1h-pyrazole, 3-methyl-1-phenyl,1h-pyrazole, methylphenyl,1h-pyrazole,3-methyl-1-phenyl,acmc-20an11,ksc494g4n,rjxlugsjemsdpk-uhfffaoysa,3-methyl-1-phenyl-1h-pyrazole # PubChem CID: 70783 IUPAC Name: 3-methyl-1-phenylpyrazole SMILES: CC1=NN(C=C1)C1=CC=CC=C1

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Specifications

PubChem CID	70783
CAS	1128-54-7
Molecular Weight (g/mol)	158.20
MDL Number	MFCD00003123
SMILES	CC1=NN(C=C1)C1=CC=CC=C1
Synonym	3-methyl-1-phenyl-1h-pyrazole,1-phenyl-3-methylpyrazole,pyrazole, 3-methyl-1-phenyl,1h-pyrazole, 3-methyl-1-phenyl,1h-pyrazole, methylphenyl,1h-pyrazole,3-methyl-1-phenyl,acmc-20an11,ksc494g4n,rjxlugsjemsdpk-uhfffaoysa,3-methyl-1-phenyl-1h-pyrazole #
IUPAC Name	3-methyl-1-phenylpyrazole
InChI Key	RJXLUGSJEMSDPK-UHFFFAOYSA-N
Molecular Formula	C10H10N2

3,926

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(R)-(-)-3-Quinuclidinol, 99+%, Thermo Scientific Chemicals

CAS: 25333-42-0 Molecular Formula: C7H13NO Molecular Weight (g/mol): 127.19 MDL Number: MFCD00211251,MFCD13191732 InChI Key: IVLICPVPXWEGCA-ZETCQYMHSA-N Synonym: r---3-quinuclidinol,r-quinuclidin-3-ol,r-3-quinuclidinol,3r-quinuclidin-3-ol,3-quinuclidinol l-form,unii-19xl022lm3,3 r-quinuclidinol,3r-1-azabicyclo 2.2.2 octan-3-ol,3-r-quinuclidinol PubChem CID: 91404 IUPAC Name: (3R)-1-azabicyclo[2.2.2]octan-3-ol SMILES: O[C@H]1CN2CCC1CC2

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Specifications

PubChem CID	91404
CAS	25333-42-0
Molecular Weight (g/mol)	127.19
MDL Number	MFCD00211251,MFCD13191732
SMILES	O[C@H]1CN2CCC1CC2
Synonym	r---3-quinuclidinol,r-quinuclidin-3-ol,r-3-quinuclidinol,3r-quinuclidin-3-ol,3-quinuclidinol l-form,unii-19xl022lm3,3 r-quinuclidinol,3r-1-azabicyclo 2.2.2 octan-3-ol,3-r-quinuclidinol
IUPAC Name	(3R)-1-azabicyclo[2.2.2]octan-3-ol
InChI Key	IVLICPVPXWEGCA-ZETCQYMHSA-N
Molecular Formula	C7H13NO

3,927

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3-Amino-5-hydroxypyrazole, 98%

CAS: 6126-22-3 MDL Number: MFCD00022384 InChI Key: QZBGOTVBHYKUDS-UHFFFAOYSA-N Synonym: 3-amino-5-hydroxypyrazole,3-amino-1h-pyrazol-5-ol,5-amino-1h-pyrazol-3-ol,5-amino-1h-pyrazol-3 2h-one,3-amino-1,2-dihydropyrazol-5-one,5-aminopyrazol-3-ol,5-amino-2h-pyrazol-3-ol,3-pyrazolin-5-one, 3-amino,5-amino-2,3-dihydro-1h-pyrazol-3-one,1h-pyrazol-5-ol, 3-amino PubChem CID: 96221 IUPAC Name: 5-amino-1,2-dihydropyrazol-3-one SMILES: C1=C(NNC1=O)N

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Specifications

PubChem CID	96221
CAS	6126-22-3
MDL Number	MFCD00022384
SMILES	C1=C(NNC1=O)N
Synonym	3-amino-5-hydroxypyrazole,3-amino-1h-pyrazol-5-ol,5-amino-1h-pyrazol-3-ol,5-amino-1h-pyrazol-3 2h-one,3-amino-1,2-dihydropyrazol-5-one,5-aminopyrazol-3-ol,5-amino-2h-pyrazol-3-ol,3-pyrazolin-5-one, 3-amino,5-amino-2,3-dihydro-1h-pyrazol-3-one,1h-pyrazol-5-ol, 3-amino
IUPAC Name	5-amino-1,2-dihydropyrazol-3-one
InChI Key	QZBGOTVBHYKUDS-UHFFFAOYSA-N

3,928

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Diethyl pyrazole-3,5-dicarboxylate, 99%, Thermo Scientific Chemicals

CAS: 37687-24-4 Molecular Formula: C9H12N2O4 Molecular Weight (g/mol): 212.21 MDL Number: MFCD00152167 InChI Key: MBWXLICVQZUJOW-UHFFFAOYSA-N Synonym: diethyl 3,5-pyrazoledicarboxylate,diethyl pyrazole-3,5-dicarboxylate,3,5-diethoxycarbonylpyrazole,1h-pyrazole-3,5-dicarboxylic acid diethyl ester,3,5-pyrazoledicarboxylic acid diethyl ester,3,5-diethyl 1h-pyrazole-3,5-dicarboxylate,1h-pyrazole-3,5-dicarboxylic acid, diethyl ester,zlchem 861,pubchem22955,acmc-1aj76 PubChem CID: 142184 IUPAC Name: diethyl 1H-pyrazole-3,5-dicarboxylate SMILES: CCOC(=O)C1=CC(=NN1)C(=O)OCC

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Specifications

PubChem CID	142184
CAS	37687-24-4
Molecular Weight (g/mol)	212.21
MDL Number	MFCD00152167
SMILES	CCOC(=O)C1=CC(=NN1)C(=O)OCC
Synonym	diethyl 3,5-pyrazoledicarboxylate,diethyl pyrazole-3,5-dicarboxylate,3,5-diethoxycarbonylpyrazole,1h-pyrazole-3,5-dicarboxylic acid diethyl ester,3,5-pyrazoledicarboxylic acid diethyl ester,3,5-diethyl 1h-pyrazole-3,5-dicarboxylate,1h-pyrazole-3,5-dicarboxylic acid, diethyl ester,zlchem 861,pubchem22955,acmc-1aj76
IUPAC Name	diethyl 1H-pyrazole-3,5-dicarboxylate
InChI Key	MBWXLICVQZUJOW-UHFFFAOYSA-N
Molecular Formula	C9H12N2O4

3,929

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Brucine, 99%, anhydrous

CAS: 357-57-3 Molecular Formula: C₂₃H₂₆N₂O₄ Molecular Weight (g/mol): 394.46 MDL Number: MFCD00005942 InChI Key: RRKTZKIUPZVBMF-VLTSECPOSA-N Synonym: brucine, anhydrous,brucine:strychnidin-10-one,2,3-dimethoxy PubChem CID: 51413923 IUPAC Name: (4aR,5aS,8aR,13aS,15aR,15bS)-10,11-dimethoxy-4a,5,5a,7,8,13a,15,15a,15b,16-decahydro-2H-4,6-methanoindolo[3,2,1-ij]oxepino[2,3,4-de]pyrrolo[2,3-h]quinoline-14-one SMILES: COC1=C(C=C2C(=C1)C34CCN5C3CC6C7C4N2C(=O)CC7OCC=C6C5)OC

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Specifications

PubChem CID	51413923
CAS	357-57-3
Molecular Weight (g/mol)	394.46
MDL Number	MFCD00005942
SMILES	COC1=C(C=C2C(=C1)C34CCN5C3CC6C7C4N2C(=O)CC7OCC=C6C5)OC
Synonym	brucine, anhydrous,brucine:strychnidin-10-one,2,3-dimethoxy
IUPAC Name	(4aR,5aS,8aR,13aS,15aR,15bS)-10,11-dimethoxy-4a,5,5a,7,8,13a,15,15a,15b,16-decahydro-2H-4,6-methanoindolo[3,2,1-ij]oxepino[2,3,4-de]pyrrolo[2,3-h]quinoline-14-one
InChI Key	RRKTZKIUPZVBMF-VLTSECPOSA-N
Molecular Formula	C₂₃H₂₆N₂O₄

3,930

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1-Methylindazole-6-boronic acid, 97%

CAS: 1150114-80-9 Molecular Formula: C8H9BN2O2 Molecular Weight (g/mol): 175.98 MDL Number: MFCD09870053 InChI Key: OMVQAWCHQBKZCF-UHFFFAOYSA-N Synonym: 1-methyl-1h-indazol-6-yl boronic acid,1-methyl-1h-indazole-6-boronic acid,1-methylindazole-6-boronic acid,1-methyl-1h-indazol-6-boronic acid,1-methyl-1h-indazol-6-ylboronic acid,6-borono-1-methyl-1h-indazole,1-methyl-1h-indazol-6-yl-6-boronic acid,pubchem20896,acmc-2099ne,1-methyl-indazole-6-boronic acid PubChem CID: 44118215 IUPAC Name: (1-methylindazol-6-yl)boronic acid SMILES: CN1N=CC2=CC=C(C=C12)B(O)O

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Specifications

PubChem CID	44118215
CAS	1150114-80-9
Molecular Weight (g/mol)	175.98
MDL Number	MFCD09870053
SMILES	CN1N=CC2=CC=C(C=C12)B(O)O
Synonym	1-methyl-1h-indazol-6-yl boronic acid,1-methyl-1h-indazole-6-boronic acid,1-methylindazole-6-boronic acid,1-methyl-1h-indazol-6-boronic acid,1-methyl-1h-indazol-6-ylboronic acid,6-borono-1-methyl-1h-indazole,1-methyl-1h-indazol-6-yl-6-boronic acid,pubchem20896,acmc-2099ne,1-methyl-indazole-6-boronic acid
IUPAC Name	(1-methylindazol-6-yl)boronic acid
InChI Key	OMVQAWCHQBKZCF-UHFFFAOYSA-N
Molecular Formula	C8H9BN2O2

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