Unclassified Organic Compounds

Organic compounds that do not fit into any other organic chemical classification.

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3,571 – 3,585 of 204,733 results

3,571

1-Benzyl L-Glutamate 98.0+%, TCI America™

CAS: 13030-09-6 Molecular Formula: C12H15NO4 Molecular Weight (g/mol): 237.255 MDL Number: MFCD00037312 InChI Key: HFZKKJHBHCZXTQ-JTQLQIEISA-N Synonym: L-Glutamic Acid 1-Benzyl Ester, H-Glu-OBzl PubChem CID: 7009632 IUPAC Name: (4S)-4-amino-5-oxo-5-phenylmethoxypentanoic acid SMILES: C1=CC=C(C=C1)COC(=O)C(CCC(=O)O)N

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Specifications

PubChem CID	7009632
CAS	13030-09-6
Molecular Weight (g/mol)	237.255
MDL Number	MFCD00037312
SMILES	C1=CC=C(C=C1)COC(=O)C(CCC(=O)O)N
Synonym	L-Glutamic Acid 1-Benzyl Ester, H-Glu-OBzl
IUPAC Name	(4S)-4-amino-5-oxo-5-phenylmethoxypentanoic acid
InChI Key	HFZKKJHBHCZXTQ-JTQLQIEISA-N
Molecular Formula	C12H15NO4

3,572

Bilobalide 95.0+%, TCI America™

CAS: 33570-04-6 Molecular Formula: C15H18O8 Molecular Weight (g/mol): 326.30 MDL Number: MFCD00132880,MFCD00238547 InChI Key: MOLPUWBMSBJXER-YDGSQGCISA-N PubChem CID: 126963541 IUPAC Name: (1S,4R,7R,8S,9R,11S)-9-tert-butyl-7,9-dihydroxy-3,5,12-trioxatetracyclo[6.6.0.0¹,¹¹.0⁴,⁸]tetradecane-2,6,13-trione SMILES: CC(C)(C)[C@]1(O)C[C@@H]2OC(=O)C[C@@]22C(=O)O[C@@H]3OC(=O)[C@H](O)[C@]123

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Specifications

PubChem CID	126963541
CAS	33570-04-6
Molecular Weight (g/mol)	326.30
MDL Number	MFCD00132880,MFCD00238547
SMILES	CC(C)(C)[C@]1(O)C[C@@H]2OC(=O)C[C@@]22C(=O)O[C@@H]3OC(=O)[C@H](O)[C@]123
IUPAC Name	(1S,4R,7R,8S,9R,11S)-9-tert-butyl-7,9-dihydroxy-3,5,12-trioxatetracyclo[6.6.0.0¹,¹¹.0⁴,⁸]tetradecane-2,6,13-trione
InChI Key	MOLPUWBMSBJXER-YDGSQGCISA-N
Molecular Formula	C15H18O8

3,573

Ethyl 4-Oxocyclohexanecarboxylate 98.0+%, TCI America™

CAS: 17159-79-4 Molecular Formula: C9H14O3 Molecular Weight (g/mol): 170.21 MDL Number: MFCD00013285 InChI Key: ZXYAWONOWHSQRU-UHFFFAOYSA-N Synonym: ethyl 4-oxocyclohexanecarboxylate,ethyl 4-cyclohexanonecarboxylate,4-ethoxycarbonyl cyclohexanone,ethyl cyclohexanone-4-carboxylate,ethyl-4-oxo-cyclohexane carboxylate,4-oxo-cyclohexanecarboxylic acid ethyl ester,cyclohexanecarboxylic acid, 4-oxo-, ethyl ester,ethyl4-oxocyclohexanecarboxylate,4-cyclohexanonecarboxylic acid ethyl ester,ethyl 4-oxocyclohexane carboxylate PubChem CID: 317638 IUPAC Name: ethyl 4-oxocyclohexane-1-carboxylate SMILES: CCOC(=O)C1CCC(=O)CC1

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Specifications

PubChem CID	317638
CAS	17159-79-4
Molecular Weight (g/mol)	170.21
MDL Number	MFCD00013285
SMILES	CCOC(=O)C1CCC(=O)CC1
Synonym	ethyl 4-oxocyclohexanecarboxylate,ethyl 4-cyclohexanonecarboxylate,4-ethoxycarbonyl cyclohexanone,ethyl cyclohexanone-4-carboxylate,ethyl-4-oxo-cyclohexane carboxylate,4-oxo-cyclohexanecarboxylic acid ethyl ester,cyclohexanecarboxylic acid, 4-oxo-, ethyl ester,ethyl4-oxocyclohexanecarboxylate,4-cyclohexanonecarboxylic acid ethyl ester,ethyl 4-oxocyclohexane carboxylate
IUPAC Name	ethyl 4-oxocyclohexane-1-carboxylate
InChI Key	ZXYAWONOWHSQRU-UHFFFAOYSA-N
Molecular Formula	C9H14O3

3,574

2,6-Dimethyloctane 90.0+%, TCI America™

CAS: 2051-30-1 Molecular Formula: C10H22 Molecular Weight (g/mol): 142.286 MDL Number: MFCD00042892 InChI Key: ZALHPSXXQIPKTQ-UHFFFAOYSA-N PubChem CID: 16319 IUPAC Name: 2,6-dimethyloctane SMILES: CCC(C)CCCC(C)C

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Specifications

PubChem CID	16319
CAS	2051-30-1
Molecular Weight (g/mol)	142.286
MDL Number	MFCD00042892
SMILES	CCC(C)CCCC(C)C
IUPAC Name	2,6-dimethyloctane
InChI Key	ZALHPSXXQIPKTQ-UHFFFAOYSA-N
Molecular Formula	C10H22

3,575

1,2,3,4,5-Pentaphenyl-1'-(di-tert-butylphosphino)ferrocene 98.0+%, TCI America™

CAS: 312959-24-3 Molecular Formula: C48H47FeP Molecular Weight (g/mol): 710.72 MDL Number: MFCD03788940 Synonym: QPhos IUPAC Name: 1,2,3,4,5-Pentaphenyl-1'-(di-tert-butylphosphino)ferrocene SMILES: [Fe].CC(C)(C)P(c1cccc1)C(C)(C)C.C1=CC=C(C=C1)c1c(c(c(c1C1=CC=CC=C1)C1=CC=CC=C1)C1=CC=CC=C1)C1=CC=CC=C1

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Specifications

CAS	312959-24-3
Molecular Weight (g/mol)	710.72
MDL Number	MFCD03788940
SMILES	[Fe].CC(C)(C)P(c1cccc1)C(C)(C)C.C1=CC=C(C=C1)c1c(c(c(c1C1=CC=CC=C1)C1=CC=CC=C1)C1=CC=CC=C1)C1=CC=CC=C1
Synonym	QPhos
IUPAC Name	1,2,3,4,5-Pentaphenyl-1'-(di-tert-butylphosphino)ferrocene
Molecular Formula	C48H47FeP

3,576

N-Chloroacetyl-DL-alanine 98.0+%, TCI America™

CAS: 1190-32-5 Molecular Formula: C5H8ClNO3 Molecular Weight (g/mol): 165.573 MDL Number: MFCD00020401 InChI Key: HTAQFYLADZNZHZ-UHFFFAOYSA-N PubChem CID: 102573 IUPAC Name: 2-[(2-chloroacetyl)amino]propanoic acid SMILES: CC(C(=O)O)NC(=O)CCl

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Specifications

PubChem CID	102573
CAS	1190-32-5
Molecular Weight (g/mol)	165.573
MDL Number	MFCD00020401
SMILES	CC(C(=O)O)NC(=O)CCl
IUPAC Name	2-[(2-chloroacetyl)amino]propanoic acid
InChI Key	HTAQFYLADZNZHZ-UHFFFAOYSA-N
Molecular Formula	C5H8ClNO3

3,577

1-Benzyl D-Aspartate 98.0+%, TCI America™

CAS: 79337-40-9 Molecular Formula: C11H13NO4 Molecular Weight (g/mol): 223.228 InChI Key: NJSRYBIBUXBNSW-SECBINFHSA-N Synonym: 1-benzyl d-aspartate,d-aspartic acid alpha-benzyl ester,3r-3-amino-4-oxo-4-phenylmethoxybutanoic acid,3r-3-amino-4-benzyloxy-4-oxobutanoic acid,1-benzyld-aspartate,d-aspartic acid,a-benzyl ester,d-aspartic acid 1-benzyl ester,d-aspartic acid, 1-phenylmethyl ester PubChem CID: 6995008 IUPAC Name: (3R)-3-amino-4-oxo-4-phenylmethoxybutanoic acid SMILES: C1=CC=C(C=C1)COC(=O)C(CC(=O)O)N

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Specifications

PubChem CID	6995008
CAS	79337-40-9
Molecular Weight (g/mol)	223.228
SMILES	C1=CC=C(C=C1)COC(=O)C(CC(=O)O)N
Synonym	1-benzyl d-aspartate,d-aspartic acid alpha-benzyl ester,3r-3-amino-4-oxo-4-phenylmethoxybutanoic acid,3r-3-amino-4-benzyloxy-4-oxobutanoic acid,1-benzyld-aspartate,d-aspartic acid,a-benzyl ester,d-aspartic acid 1-benzyl ester,d-aspartic acid, 1-phenylmethyl ester
IUPAC Name	(3R)-3-amino-4-oxo-4-phenylmethoxybutanoic acid
InChI Key	NJSRYBIBUXBNSW-SECBINFHSA-N
Molecular Formula	C11H13NO4

3,578

Ranolazine Dihydrochloride 98.0+%, TCI America™

CAS: 95635-56-6 Molecular Formula: C24H35Cl2N3O4 Molecular Weight (g/mol): 500.46 MDL Number: MFCD03788770 InChI Key: RJNSNFZXAZXOFX-UHFFFAOYNA-N Synonym: ranolazine dihydrochloride,ranolazine hcl,ranolazine hydrochloride,renolazine,n-2,6-dimethylphenyl-2-4-2-hydroxy-3-2-methoxyphenoxy propyl piperazin-1-yl acetamide dihydrochloride,ranolazine hydrochloride usan,ranolazine 2hcl,+--4-2-hydroxy-3-o-methoxyphenoxy propyl-1-piperazineaceto-2',6'-xylidide dihydrochloride PubChem CID: 71279 IUPAC Name: dihydrogen N-(2,6-dimethylphenyl)-2-{4-[2-hydroxy-3-(2-methoxyphenoxy)propyl]piperazin-1-yl}acetamide dichloride SMILES: [H+].[H+].[Cl-].[Cl-].COC1=CC=CC=C1OCC(O)CN1CCN(CC(=O)NC2=C(C)C=CC=C2C)CC1

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Specifications

PubChem CID	71279
CAS	95635-56-6
Molecular Weight (g/mol)	500.46
MDL Number	MFCD03788770
SMILES	[H+].[H+].[Cl-].[Cl-].COC1=CC=CC=C1OCC(O)CN1CCN(CC(=O)NC2=C(C)C=CC=C2C)CC1
Synonym	ranolazine dihydrochloride,ranolazine hcl,ranolazine hydrochloride,renolazine,n-2,6-dimethylphenyl-2-4-2-hydroxy-3-2-methoxyphenoxy propyl piperazin-1-yl acetamide dihydrochloride,ranolazine hydrochloride usan,ranolazine 2hcl,+--4-2-hydroxy-3-o-methoxyphenoxy propyl-1-piperazineaceto-2',6'-xylidide dihydrochloride
IUPAC Name	dihydrogen N-(2,6-dimethylphenyl)-2-{4-[2-hydroxy-3-(2-methoxyphenoxy)propyl]piperazin-1-yl}acetamide dichloride
InChI Key	RJNSNFZXAZXOFX-UHFFFAOYNA-N
Molecular Formula	C24H35Cl2N3O4

3,579

Diethyl(methyl)propylammonium Bis(fluorosulfonyl)imide 98.0+%, TCI America™

CAS: 1235234-32-8 Molecular Formula: C8H20F2N2O4S2 Molecular Weight (g/mol): 310.375 InChI Key: JVCJTUSCMOJHBG-UHFFFAOYSA-N PubChem CID: 121234257 IUPAC Name: bis(fluorosulfonyl)azanide;diethyl-methyl-propylazanium SMILES: CCC[N+](C)(CC)CC.[N-](S(=O)(=O)F)S(=O)(=O)F

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Specifications

PubChem CID	121234257
CAS	1235234-32-8
Molecular Weight (g/mol)	310.375
SMILES	CCC[N+](C)(CC)CC.[N-](S(=O)(=O)F)S(=O)(=O)F
IUPAC Name	bis(fluorosulfonyl)azanide;diethyl-methyl-propylazanium
InChI Key	JVCJTUSCMOJHBG-UHFFFAOYSA-N
Molecular Formula	C8H20F2N2O4S2

3,580

3-Oxocyclobutanecarboxylic Acid 97.0+%, TCI America™

CAS: 23761-23-1 Molecular Formula: C5H6O3 Molecular Weight (g/mol): 114.10 MDL Number: MFCD00100900 InChI Key: IENOFRJPUPTEMI-UHFFFAOYSA-N Synonym: 3-oxocyclobutanecarboxylic acid,3-oxo-cyclobutanecarboxylic acid,cyclobutanecarboxylic acid, 3-oxo,3-oxo-cyclobutanecarboxylicacid,1-carboxy-3-oxocyclobutane,3-oxocyclobutyl carboxylic acid,3-oxocyclobutanecarboxylicacid,pubchem14220,acmc-1cak7,ksc201q6h PubChem CID: 4913358 IUPAC Name: 3-oxocyclobutane-1-carboxylic acid SMILES: OC(=O)C1CC(=O)C1

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Specifications

PubChem CID	4913358
CAS	23761-23-1
Molecular Weight (g/mol)	114.10
MDL Number	MFCD00100900
SMILES	OC(=O)C1CC(=O)C1
Synonym	3-oxocyclobutanecarboxylic acid,3-oxo-cyclobutanecarboxylic acid,cyclobutanecarboxylic acid, 3-oxo,3-oxo-cyclobutanecarboxylicacid,1-carboxy-3-oxocyclobutane,3-oxocyclobutyl carboxylic acid,3-oxocyclobutanecarboxylicacid,pubchem14220,acmc-1cak7,ksc201q6h
IUPAC Name	3-oxocyclobutane-1-carboxylic acid
InChI Key	IENOFRJPUPTEMI-UHFFFAOYSA-N
Molecular Formula	C5H6O3

3,581

4-[3-(Trifluoromethyl)-3H-diazirin-3-yl]benzoic Acid 98.0+%, TCI America™

CAS: 85559-46-2 Molecular Formula: C9H5F3N2O2 Molecular Weight (g/mol): 230.146 MDL Number: MFCD00236809 InChI Key: CZPAJVBVULSLGG-UHFFFAOYSA-N PubChem CID: 128718 IUPAC Name: 4-[3-(trifluoromethyl)diazirin-3-yl]benzoic acid SMILES: C1=CC(=CC=C1C(=O)O)C2(N=N2)C(F)(F)F

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Specifications

PubChem CID	128718
CAS	85559-46-2
Molecular Weight (g/mol)	230.146
MDL Number	MFCD00236809
SMILES	C1=CC(=CC=C1C(=O)O)C2(N=N2)C(F)(F)F
IUPAC Name	4-[3-(trifluoromethyl)diazirin-3-yl]benzoic acid
InChI Key	CZPAJVBVULSLGG-UHFFFAOYSA-N
Molecular Formula	C9H5F3N2O2

3,582

N-(tert-Butoxycarbonyl)-D-proline 98.0+%, TCI America™

CAS: 37784-17-1 Molecular Formula: C10H17NO4 Molecular Weight (g/mol): 215.249 MDL Number: MFCD00063226 InChI Key: ZQEBQGAAWMOMAI-SSDOTTSWSA-N Synonym: n-boc-d-proline,boc-d-proline,boc-d-pro-oh,r-1-tert-butoxycarbonyl pyrrolidine-2-carboxylic acid,n-tert-butoxycarbonyl-d-proline,2r-1-tert-butoxy carbonyl pyrrolidine-2-carboxylic acid,n-t-boc-d-proline,boc-d-pro,n-alpha-t-boc-d-proline,1-tert-butoxycarbonyl-d-proline PubChem CID: 688022 IUPAC Name: (2R)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid SMILES: CC(C)(C)OC(=O)N1CCCC1C(=O)O

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Specifications

PubChem CID	688022
CAS	37784-17-1
Molecular Weight (g/mol)	215.249
MDL Number	MFCD00063226
SMILES	CC(C)(C)OC(=O)N1CCCC1C(=O)O
Synonym	n-boc-d-proline,boc-d-proline,boc-d-pro-oh,r-1-tert-butoxycarbonyl pyrrolidine-2-carboxylic acid,n-tert-butoxycarbonyl-d-proline,2r-1-tert-butoxy carbonyl pyrrolidine-2-carboxylic acid,n-t-boc-d-proline,boc-d-pro,n-alpha-t-boc-d-proline,1-tert-butoxycarbonyl-d-proline
IUPAC Name	(2R)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid
InChI Key	ZQEBQGAAWMOMAI-SSDOTTSWSA-N
Molecular Formula	C10H17NO4

3,583

1,2-Bis[2,3,5,6-tetrafluoro-4-(trifluoromethyl)phenyl]-3,3,4,4,5,5-hexafluoro-1-cyclopentene 95.0+%, TCI America™

CAS: 1821062-80-9 Molecular Formula: C19F20 Molecular Weight (g/mol): 608.177 InChI Key: VDETZPYQAWUCIA-UHFFFAOYSA-N Synonym: 6,6′-(Perfluorocyclopent-1-ene-1,2-diyl)bis[1,2,4,5-tetrafluoro-3-(trifluoromethyl)benzene] PubChem CID: 122204810 IUPAC Name: 1,2,4,5-tetrafluoro-3-[3,3,4,4,5,5-hexafluoro-2-[2,3,5,6-tetrafluoro-4-(trifluoromethyl)phenyl]cyclopenten-1-yl]-6-(trifluoromethyl)benzene SMILES: C1(=C(C(=C(C(=C1F)F)C(F)(F)F)F)F)C2=C(C(C(C2(F)F)(F)F)(F)F)C3=C(C(=C(C(=C3F)F)C(F)(F)F)F)F

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Specifications

PubChem CID	122204810
CAS	1821062-80-9
Molecular Weight (g/mol)	608.177
SMILES	C1(=C(C(=C(C(=C1F)F)C(F)(F)F)F)F)C2=C(C(C(C2(F)F)(F)F)(F)F)C3=C(C(=C(C(=C3F)F)C(F)(F)F)F)F
Synonym	6,6′-(Perfluorocyclopent-1-ene-1,2-diyl)bis[1,2,4,5-tetrafluoro-3-(trifluoromethyl)benzene]
IUPAC Name	1,2,4,5-tetrafluoro-3-[3,3,4,4,5,5-hexafluoro-2-[2,3,5,6-tetrafluoro-4-(trifluoromethyl)phenyl]cyclopenten-1-yl]-6-(trifluoromethyl)benzene
InChI Key	VDETZPYQAWUCIA-UHFFFAOYSA-N
Molecular Formula	C19F20

3,584

(R)-RUCY(regR)-XylBINAP, TCI America™

CAS: 1384974-38-2 Molecular Formula: C71H73ClN2O2P2Ru MDL Number: MFCD20261161 Synonym: RuCl[(R)-daipena][(R)-xylbinap]

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Specifications

CAS	1384974-38-2
MDL Number	MFCD20261161
Synonym	RuCl[(R)-daipena][(R)-xylbinap]
Molecular Formula	C71H73ClN2O2P2Ru

3,585

Zinc 2-Mercaptobenzothiazole 98.0+%, TCI America™

CAS: 155-04-4 Molecular Formula: C7H4NS2Zn+ Molecular Weight (g/mol): 231.616 MDL Number: MFCD00072234 InChI Key: JLKZUNOWPPEBPX-UHFFFAOYSA-M Synonym: 2-Mercaptobenzothiazole Zinc Salt, Zinc 2-Benzothiazolethiolate PubChem CID: 25200224 IUPAC Name: zinc;1,3-benzothiazole-2-thiolate SMILES: C1=CC=C2C(=C1)N=C(S2)[S-].[Zn+2]

Pricing & Availability
Specifications

PubChem CID	25200224
CAS	155-04-4
Molecular Weight (g/mol)	231.616
MDL Number	MFCD00072234
SMILES	C1=CC=C2C(=C1)N=C(S2)[S-].[Zn+2]
Synonym	2-Mercaptobenzothiazole Zinc Salt, Zinc 2-Benzothiazolethiolate
IUPAC Name	zinc;1,3-benzothiazole-2-thiolate
InChI Key	JLKZUNOWPPEBPX-UHFFFAOYSA-M
Molecular Formula	C7H4NS2Zn+

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