Carbonyl compounds
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1-(2-Phenyl-1,3-thiazol-4-yl)ethan-1-one, 97%, Thermo Scientific™
CAS: 10045-52-0 Molecular Formula: C11H9NOS Molecular Weight (g/mol): 203.259 MDL Number: MFCD00068112 InChI Key: ZOOGZFPRAKXWKI-UHFFFAOYSA-N Synonym: 1-2-phenylthiazol-4-yl ethanone,1-2-phenyl-1,3-thiazol-4-yl ethan-1-one,1-2-phenyl-1,3-thiazol-4-yl ethanone,4-acetyl-2-phenylthiazole,1-2-phenyl-1,3-thiazol-4-yl-1-ethanone,ethanone, 1-2-phenyl-4-thiazolyl,4-acetyl-2-phenyl-1,3-thiazole,maybridge1_008631,buttpark 15357-18,2-phenyl-4-acetylthiazole PubChem CID: 604819 IUPAC Name: 1-(2-phenyl-1,3-thiazol-4-yl)ethanone SMILES: CC(=O)C1=CSC(=N1)C2=CC=CC=C2
| PubChem CID | 604819 |
|---|---|
| CAS | 10045-52-0 |
| Molecular Weight (g/mol) | 203.259 |
| MDL Number | MFCD00068112 |
| SMILES | CC(=O)C1=CSC(=N1)C2=CC=CC=C2 |
| Synonym | 1-2-phenylthiazol-4-yl ethanone,1-2-phenyl-1,3-thiazol-4-yl ethan-1-one,1-2-phenyl-1,3-thiazol-4-yl ethanone,4-acetyl-2-phenylthiazole,1-2-phenyl-1,3-thiazol-4-yl-1-ethanone,ethanone, 1-2-phenyl-4-thiazolyl,4-acetyl-2-phenyl-1,3-thiazole,maybridge1_008631,buttpark 15357-18,2-phenyl-4-acetylthiazole |
| IUPAC Name | 1-(2-phenyl-1,3-thiazol-4-yl)ethanone |
| InChI Key | ZOOGZFPRAKXWKI-UHFFFAOYSA-N |
| Molecular Formula | C11H9NOS |
Ethyl 2-ethylacetoacetate, 95%
CAS: 607-97-6 Molecular Formula: C8H14O3 Molecular Weight (g/mol): 158.197 MDL Number: MFCD00039898 InChI Key: OKANYBNORCUPKZ-UHFFFAOYSA-N Synonym: ethyl 2-ethylacetoacetate,ethyl 2-acetylbutyrate,butanoic acid, 2-ethyl-3-oxo-, ethyl ester,2-ethylacetoacetic acid ethyl ester,ethyl 2-ethyl-3-ketobutyrate,ethyl alpha-ethylacetoacetate,ethyl-2-ethylacetoacetate,2-ethyl-3-oxo-butyric acid ethyl ester,ethyl .alpha.-acetylbutyrate,ethyl 2-ethyl-3-oxo-butanoate PubChem CID: 79065 IUPAC Name: ethyl 2-ethyl-3-oxobutanoate SMILES: CCC(C(=O)C)C(=O)OCC
| PubChem CID | 79065 |
|---|---|
| CAS | 607-97-6 |
| Molecular Weight (g/mol) | 158.197 |
| MDL Number | MFCD00039898 |
| SMILES | CCC(C(=O)C)C(=O)OCC |
| Synonym | ethyl 2-ethylacetoacetate,ethyl 2-acetylbutyrate,butanoic acid, 2-ethyl-3-oxo-, ethyl ester,2-ethylacetoacetic acid ethyl ester,ethyl 2-ethyl-3-ketobutyrate,ethyl alpha-ethylacetoacetate,ethyl-2-ethylacetoacetate,2-ethyl-3-oxo-butyric acid ethyl ester,ethyl .alpha.-acetylbutyrate,ethyl 2-ethyl-3-oxo-butanoate |
| IUPAC Name | ethyl 2-ethyl-3-oxobutanoate |
| InChI Key | OKANYBNORCUPKZ-UHFFFAOYSA-N |
| Molecular Formula | C8H14O3 |
4'-Methoxybutyrophenone, 97%
CAS: 4160-51-4 Molecular Formula: C11H14O2 Molecular Weight (g/mol): 178.23 MDL Number: MFCD00027138 InChI Key: JLCDSZXBELPBRD-UHFFFAOYSA-N Synonym: 4'-methoxybutyrophenone,1-4-methoxyphenyl butan-1-one,p-methoxybutyrophenone,4-methoxybutyrophenone,1-butanone, 1-4-methoxyphenyl,butyrophenone, 4'-methoxy,1-4-methoxyphenyl-1-butanone,4-butyrylanisole,acmc-209jkw,4'-methoxy-butyrophenone PubChem CID: 77810 IUPAC Name: 1-(4-methoxyphenyl)butan-1-one SMILES: CCCC(=O)C1=CC=C(OC)C=C1
| PubChem CID | 77810 |
|---|---|
| CAS | 4160-51-4 |
| Molecular Weight (g/mol) | 178.23 |
| MDL Number | MFCD00027138 |
| SMILES | CCCC(=O)C1=CC=C(OC)C=C1 |
| Synonym | 4'-methoxybutyrophenone,1-4-methoxyphenyl butan-1-one,p-methoxybutyrophenone,4-methoxybutyrophenone,1-butanone, 1-4-methoxyphenyl,butyrophenone, 4'-methoxy,1-4-methoxyphenyl-1-butanone,4-butyrylanisole,acmc-209jkw,4'-methoxy-butyrophenone |
| IUPAC Name | 1-(4-methoxyphenyl)butan-1-one |
| InChI Key | JLCDSZXBELPBRD-UHFFFAOYSA-N |
| Molecular Formula | C11H14O2 |
4-Bromoindole-3-carboxaldehyde, 97%, Thermo Scientific Chemicals
CAS: 98600-34-1 Molecular Formula: C9H6BrNO Molecular Weight (g/mol): 224.057 MDL Number: MFCD05864695 InChI Key: IPAFHZDRYAWZOB-UHFFFAOYSA-N Synonym: 4-bromoindole-3-carboxaldehyde,4-bromoindole-3-carboxyaldehyde,4-bromo-3-formylindole,4-bromo-1h-indole-3-carboxaldehyde,4-bromoindole-3-carbaldehyde,4-bromo-3-formyl-1h-indole,1h-indole-3-carboxaldehyde, 4-bromo,4-bromo-3-indolecarbaldehyde,pubchem7682,acmc-209saq PubChem CID: 2763178 IUPAC Name: 4-bromo-1H-indole-3-carbaldehyde SMILES: C1=CC2=C(C(=C1)Br)C(=CN2)C=O
| PubChem CID | 2763178 |
|---|---|
| CAS | 98600-34-1 |
| Molecular Weight (g/mol) | 224.057 |
| MDL Number | MFCD05864695 |
| SMILES | C1=CC2=C(C(=C1)Br)C(=CN2)C=O |
| Synonym | 4-bromoindole-3-carboxaldehyde,4-bromoindole-3-carboxyaldehyde,4-bromo-3-formylindole,4-bromo-1h-indole-3-carboxaldehyde,4-bromoindole-3-carbaldehyde,4-bromo-3-formyl-1h-indole,1h-indole-3-carboxaldehyde, 4-bromo,4-bromo-3-indolecarbaldehyde,pubchem7682,acmc-209saq |
| IUPAC Name | 4-bromo-1H-indole-3-carbaldehyde |
| InChI Key | IPAFHZDRYAWZOB-UHFFFAOYSA-N |
| Molecular Formula | C9H6BrNO |
Acetovanillone, 98%
CAS: 498-02-2 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.18 MDL Number: MFCD00008747 InChI Key: DFYRUELUNQRZTB-UHFFFAOYSA-N Synonym: acetovanillone,apocynin,4'-hydroxy-3'-methoxyacetophenone,1-4-hydroxy-3-methoxyphenyl ethanone,acetoguaiacone,acetoguaiacon,apocynine,4-acetyl-2-methoxyphenol,acetovanilone,acetovanyllon PubChem CID: 2214 ChEBI: CHEBI:2781 IUPAC Name: 1-(4-hydroxy-3-methoxyphenyl)ethanone SMILES: COC1=CC(=CC=C1O)C(C)=O
| PubChem CID | 2214 |
|---|---|
| CAS | 498-02-2 |
| Molecular Weight (g/mol) | 166.18 |
| ChEBI | CHEBI:2781 |
| MDL Number | MFCD00008747 |
| SMILES | COC1=CC(=CC=C1O)C(C)=O |
| Synonym | acetovanillone,apocynin,4'-hydroxy-3'-methoxyacetophenone,1-4-hydroxy-3-methoxyphenyl ethanone,acetoguaiacone,acetoguaiacon,apocynine,4-acetyl-2-methoxyphenol,acetovanilone,acetovanyllon |
| IUPAC Name | 1-(4-hydroxy-3-methoxyphenyl)ethanone |
| InChI Key | DFYRUELUNQRZTB-UHFFFAOYSA-N |
| Molecular Formula | C9H10O3 |
1-Benzoylacetone, 98%
CAS: 93-91-4 Molecular Formula: C10H10O2 Molecular Weight (g/mol): 162.19 MDL Number: MFCD00008786 InChI Key: CVBUKMMMRLOKQR-UHFFFAOYSA-N Synonym: benzoylacetone,1-phenyl-1,3-butanedione,1-benzoylacetone,1,3-butanedione, 1-phenyl,1-benzoyl-2-propanone,acetoacetophenone,2-propanone, benzoyl,acetylbenzoylmethane,2-acetylacetophenone,benzoyl-aceton PubChem CID: 7166 IUPAC Name: 1-phenylbutane-1,3-dione SMILES: CC(=O)CC(=O)C1=CC=CC=C1
| PubChem CID | 7166 |
|---|---|
| CAS | 93-91-4 |
| Molecular Weight (g/mol) | 162.19 |
| MDL Number | MFCD00008786 |
| SMILES | CC(=O)CC(=O)C1=CC=CC=C1 |
| Synonym | benzoylacetone,1-phenyl-1,3-butanedione,1-benzoylacetone,1,3-butanedione, 1-phenyl,1-benzoyl-2-propanone,acetoacetophenone,2-propanone, benzoyl,acetylbenzoylmethane,2-acetylacetophenone,benzoyl-aceton |
| IUPAC Name | 1-phenylbutane-1,3-dione |
| InChI Key | CVBUKMMMRLOKQR-UHFFFAOYSA-N |
| Molecular Formula | C10H10O2 |
4-Ethoxybenzaldehyde, 97+%
CAS: 10031-82-0 Molecular Formula: C9H10O2 Molecular Weight (g/mol): 150.18 MDL Number: MFCD00003388 InChI Key: JRHHJNMASOIRDS-UHFFFAOYSA-N Synonym: benzaldehyde, 4-ethoxy,p-ethoxybenzaldehyde,ethoxybenzaldehyde,benzaldehyde, p-ethoxy,homoanisaldehyde,4-ethyloxy benzaldehyde,unii-gow1h0f49a,fema no. 2413,4-ethoxy-benzaldehyde,ethoxybenzaldehyde, p PubChem CID: 24834 IUPAC Name: 4-ethoxybenzaldehyde SMILES: CCOC1=CC=C(C=O)C=C1
| PubChem CID | 24834 |
|---|---|
| CAS | 10031-82-0 |
| Molecular Weight (g/mol) | 150.18 |
| MDL Number | MFCD00003388 |
| SMILES | CCOC1=CC=C(C=O)C=C1 |
| Synonym | benzaldehyde, 4-ethoxy,p-ethoxybenzaldehyde,ethoxybenzaldehyde,benzaldehyde, p-ethoxy,homoanisaldehyde,4-ethyloxy benzaldehyde,unii-gow1h0f49a,fema no. 2413,4-ethoxy-benzaldehyde,ethoxybenzaldehyde, p |
| IUPAC Name | 4-ethoxybenzaldehyde |
| InChI Key | JRHHJNMASOIRDS-UHFFFAOYSA-N |
| Molecular Formula | C9H10O2 |
4-Acetylpyridine, 98%
CAS: 1122-54-9 Molecular Formula: C7H7NO Molecular Weight (g/mol): 121.139 MDL Number: MFCD00006433 InChI Key: WMQUKDQWMMOHSA-UHFFFAOYSA-N Synonym: 4-acetylpyridine,methyl 4-pyridyl ketone,ethanone, 1-4-pyridinyl,ketone, methyl 4-pyridyl,1-pyridin-4-yl ethan-1-one,1-pyridin-4-yl ethanone,pyridine, 4-acetyl,4-acetyl pyridine,4-pyridyl methyl ketone,unii-g47437iow7 PubChem CID: 14282 IUPAC Name: 1-pyridin-4-ylethanone SMILES: CC(=O)C1=CC=NC=C1
| PubChem CID | 14282 |
|---|---|
| CAS | 1122-54-9 |
| Molecular Weight (g/mol) | 121.139 |
| MDL Number | MFCD00006433 |
| SMILES | CC(=O)C1=CC=NC=C1 |
| Synonym | 4-acetylpyridine,methyl 4-pyridyl ketone,ethanone, 1-4-pyridinyl,ketone, methyl 4-pyridyl,1-pyridin-4-yl ethan-1-one,1-pyridin-4-yl ethanone,pyridine, 4-acetyl,4-acetyl pyridine,4-pyridyl methyl ketone,unii-g47437iow7 |
| IUPAC Name | 1-pyridin-4-ylethanone |
| InChI Key | WMQUKDQWMMOHSA-UHFFFAOYSA-N |
| Molecular Formula | C7H7NO |
6-Bromo-2-pyridinecarboxaldehyde, 97%
CAS: 34160-40-2 Molecular Formula: C6H4BrNO Molecular Weight (g/mol): 186.01 MDL Number: MFCD02683546 InChI Key: QWFHFNGMCPMOCD-UHFFFAOYSA-N Synonym: 6-bromo-2-pyridinecarboxaldehyde,6-bromopicolinaldehyde,6-bromo-2-formylpyridine,6-bromopyridine-2-carboxaldehyde,2-bromo-6-formylpyridine,6-bromo-pyridine-2-carbaldehyde,2-pyridinecarboxaldehyde, 6-bromo,2-bromopyridine-6-carboxaldehyde,6-bromo-2-pyridine carboxaldehyde,6-bromopicolylaldehyde PubChem CID: 2757009 IUPAC Name: 6-bromopyridine-2-carbaldehyde SMILES: C1=CC(=NC(=C1)Br)C=O
| PubChem CID | 2757009 |
|---|---|
| CAS | 34160-40-2 |
| Molecular Weight (g/mol) | 186.01 |
| MDL Number | MFCD02683546 |
| SMILES | C1=CC(=NC(=C1)Br)C=O |
| Synonym | 6-bromo-2-pyridinecarboxaldehyde,6-bromopicolinaldehyde,6-bromo-2-formylpyridine,6-bromopyridine-2-carboxaldehyde,2-bromo-6-formylpyridine,6-bromo-pyridine-2-carbaldehyde,2-pyridinecarboxaldehyde, 6-bromo,2-bromopyridine-6-carboxaldehyde,6-bromo-2-pyridine carboxaldehyde,6-bromopicolylaldehyde |
| IUPAC Name | 6-bromopyridine-2-carbaldehyde |
| InChI Key | QWFHFNGMCPMOCD-UHFFFAOYSA-N |
| Molecular Formula | C6H4BrNO |
7-Fluoroisatin, 97%
CAS: 317-20-4 Molecular Formula: C8H4FNO2 Molecular Weight (g/mol): 165.123 MDL Number: MFCD01569508 InChI Key: HGBGVEOXPHGSOS-UHFFFAOYSA-N Synonym: 7-fluoroisatin,7-fluoroindoline-2,3-dione,7-fluoro-2,3-indolinedione,1h-indole-2,3-dione, 7-fluoro,7-fluoroindole-1h-2,3-dione,7-fluoroindole-2,3-dione,7-fluoro-2,3-dihydro-1h-indole-2,3-dione,7-fluoroisatine,7-fluoro-1h-benzo d azoline-2,3-dione,7-fluor-1h-indol-2,3-dion PubChem CID: 586418 IUPAC Name: 7-fluoro-1H-indole-2,3-dione SMILES: C1=CC2=C(C(=C1)F)NC(=O)C2=O
| PubChem CID | 586418 |
|---|---|
| CAS | 317-20-4 |
| Molecular Weight (g/mol) | 165.123 |
| MDL Number | MFCD01569508 |
| SMILES | C1=CC2=C(C(=C1)F)NC(=O)C2=O |
| Synonym | 7-fluoroisatin,7-fluoroindoline-2,3-dione,7-fluoro-2,3-indolinedione,1h-indole-2,3-dione, 7-fluoro,7-fluoroindole-1h-2,3-dione,7-fluoroindole-2,3-dione,7-fluoro-2,3-dihydro-1h-indole-2,3-dione,7-fluoroisatine,7-fluoro-1h-benzo d azoline-2,3-dione,7-fluor-1h-indol-2,3-dion |
| IUPAC Name | 7-fluoro-1H-indole-2,3-dione |
| InChI Key | HGBGVEOXPHGSOS-UHFFFAOYSA-N |
| Molecular Formula | C8H4FNO2 |
Diethyl 2-(2-cyanoethyl)malonate, 98+%
CAS: 17216-62-5 Molecular Formula: C10H15NO4 Molecular Weight (g/mol): 213.233 MDL Number: MFCD00001966 InChI Key: YJJLOESDBPRZIP-UHFFFAOYSA-N PubChem CID: 87005 IUPAC Name: diethyl 2-(2-cyanoethyl)propanedioate SMILES: CCOC(=O)C(CCC#N)C(=O)OCC
| PubChem CID | 87005 |
|---|---|
| CAS | 17216-62-5 |
| Molecular Weight (g/mol) | 213.233 |
| MDL Number | MFCD00001966 |
| SMILES | CCOC(=O)C(CCC#N)C(=O)OCC |
| IUPAC Name | diethyl 2-(2-cyanoethyl)propanedioate |
| InChI Key | YJJLOESDBPRZIP-UHFFFAOYSA-N |
| Molecular Formula | C10H15NO4 |
4'-Methoxyacetophenone, 99%
CAS: 100-06-1 Molecular Formula: C9H10O2 Molecular Weight (g/mol): 150.18 MDL Number: MFCD00008745 InChI Key: NTPLXRHDUXRPNE-UHFFFAOYSA-N Synonym: 4'-methoxyacetophenone,4-acetylanisole,4-methoxyacetophenone,1-4-methoxyphenyl ethanone,p-methoxyacetophenone,acetanisole,novatone,linarodin,vananote,ethanone, 1-4-methoxyphenyl PubChem CID: 7476 ChEBI: CHEBI:86567 IUPAC Name: 1-(4-methoxyphenyl)ethanone SMILES: COC1=CC=C(C=C1)C(C)=O
| PubChem CID | 7476 |
|---|---|
| CAS | 100-06-1 |
| Molecular Weight (g/mol) | 150.18 |
| ChEBI | CHEBI:86567 |
| MDL Number | MFCD00008745 |
| SMILES | COC1=CC=C(C=C1)C(C)=O |
| Synonym | 4'-methoxyacetophenone,4-acetylanisole,4-methoxyacetophenone,1-4-methoxyphenyl ethanone,p-methoxyacetophenone,acetanisole,novatone,linarodin,vananote,ethanone, 1-4-methoxyphenyl |
| IUPAC Name | 1-(4-methoxyphenyl)ethanone |
| InChI Key | NTPLXRHDUXRPNE-UHFFFAOYSA-N |
| Molecular Formula | C9H10O2 |
6-piperidin-1-ylnicotinaldehyde, Thermo Scientific™
CAS: 241816-11-5 Molecular Formula: C11H14N2O Molecular Weight (g/mol): 190.246 InChI Key: RKIMIISNVCLRLA-UHFFFAOYSA-N Synonym: 6-piperidin-1-ylnicotinaldehyde,6-piperidin-1-yl nicotinaldehyde,6-piperidin-1-yl pyridine-3-carbaldehyde,6-piperidinonicotinaldehyde,6-1-piperidinyl nicotinaldehyde,6-1-piperidinyl pyridine-3-carboxaldehyde,6-piperidylpyridine-3-carbaldehyde,acmc-20alxp,3-pyridinecarboxaldehyde,6-1-piperidinyl,3,4,5,6-tetrahydro-2h-1,2' bipyridinyl-5'-carbaldehyde PubChem CID: 2763980 IUPAC Name: 6-piperidin-1-ylpyridine-3-carbaldehyde SMILES: C1CCN(CC1)C2=NC=C(C=C2)C=O
| PubChem CID | 2763980 |
|---|---|
| CAS | 241816-11-5 |
| Molecular Weight (g/mol) | 190.246 |
| SMILES | C1CCN(CC1)C2=NC=C(C=C2)C=O |
| Synonym | 6-piperidin-1-ylnicotinaldehyde,6-piperidin-1-yl nicotinaldehyde,6-piperidin-1-yl pyridine-3-carbaldehyde,6-piperidinonicotinaldehyde,6-1-piperidinyl nicotinaldehyde,6-1-piperidinyl pyridine-3-carboxaldehyde,6-piperidylpyridine-3-carbaldehyde,acmc-20alxp,3-pyridinecarboxaldehyde,6-1-piperidinyl,3,4,5,6-tetrahydro-2h-1,2' bipyridinyl-5'-carbaldehyde |
| IUPAC Name | 6-piperidin-1-ylpyridine-3-carbaldehyde |
| InChI Key | RKIMIISNVCLRLA-UHFFFAOYSA-N |
| Molecular Formula | C11H14N2O |
2-(Boc-amino)pyridine-5-carboxaldehyde, 97%, Thermo Scientific Chemicals
CAS: 199296-40-7 Molecular Formula: C11H14N2O3 Molecular Weight (g/mol): 222.244 MDL Number: MFCD08064228 InChI Key: WZROBBWIJBBWQP-UHFFFAOYSA-N Synonym: tert-butyl 5-formylpyridin-2-yl carbamate,tert-butyl 5-formylpyridin-2-ylcarbamate,tert-butyl n-5-formylpyridin-2-yl carbamate,2-boc-amino pyridine-5-carboxaldehyde,5-formyl-pyridin-2-yl-carbamic acid tert-butyl ester,5-formylpyridin-2-yl carbamic acid tert butyl ester,2-boc-aminopyridine-5-aldehyde,2-tert-butoxycarbonylamino pyridine-5-carboxaldehyde,carbamicacid, n-5-formyl-2-pyridinyl-, 1,1-dimethylethyl ester,6-aminonicotinaldehyde, 6-boc protected PubChem CID: 22034247 IUPAC Name: tert-butyl N-(5-formylpyridin-2-yl)carbamate SMILES: CC(C)(C)OC(=O)NC1=NC=C(C=C1)C=O
| PubChem CID | 22034247 |
|---|---|
| CAS | 199296-40-7 |
| Molecular Weight (g/mol) | 222.244 |
| MDL Number | MFCD08064228 |
| SMILES | CC(C)(C)OC(=O)NC1=NC=C(C=C1)C=O |
| Synonym | tert-butyl 5-formylpyridin-2-yl carbamate,tert-butyl 5-formylpyridin-2-ylcarbamate,tert-butyl n-5-formylpyridin-2-yl carbamate,2-boc-amino pyridine-5-carboxaldehyde,5-formyl-pyridin-2-yl-carbamic acid tert-butyl ester,5-formylpyridin-2-yl carbamic acid tert butyl ester,2-boc-aminopyridine-5-aldehyde,2-tert-butoxycarbonylamino pyridine-5-carboxaldehyde,carbamicacid, n-5-formyl-2-pyridinyl-, 1,1-dimethylethyl ester,6-aminonicotinaldehyde, 6-boc protected |
| IUPAC Name | tert-butyl N-(5-formylpyridin-2-yl)carbamate |
| InChI Key | WZROBBWIJBBWQP-UHFFFAOYSA-N |
| Molecular Formula | C11H14N2O3 |
Ethyl 2-cyanoacetoacetate
CAS: 634-55-9 Molecular Formula: C7H9NO3 Molecular Weight (g/mol): 155.15 MDL Number: MFCD00043487 InChI Key: NWOKVFOTWMZMHL-UHFFFAOYNA-N Synonym: ethyl 2-cyanoacetoacetate,ethyl 2-acetylcyanoacetate,ethyl a-cyanoacetoacetate,ethyl alpha-cyanoacetoacetate,butanoic acid, 2-cyano-3-oxo-, ethyl ester,ethyl2-acetylcyanoacetate,ethyl 2-cyano-3-oxo-butanoate,2-cyanoacetoacetic acid ethyl ester,2-cyano-3-oxo-butyric acid ethyl ester,zlchem 939 PubChem CID: 136455 ChEBI: CHEBI:51924 IUPAC Name: ethyl 2-cyano-3-oxobutanoate SMILES: CCOC(=O)C(C#N)C(C)=O
| PubChem CID | 136455 |
|---|---|
| CAS | 634-55-9 |
| Molecular Weight (g/mol) | 155.15 |
| ChEBI | CHEBI:51924 |
| MDL Number | MFCD00043487 |
| SMILES | CCOC(=O)C(C#N)C(C)=O |
| Synonym | ethyl 2-cyanoacetoacetate,ethyl 2-acetylcyanoacetate,ethyl a-cyanoacetoacetate,ethyl alpha-cyanoacetoacetate,butanoic acid, 2-cyano-3-oxo-, ethyl ester,ethyl2-acetylcyanoacetate,ethyl 2-cyano-3-oxo-butanoate,2-cyanoacetoacetic acid ethyl ester,2-cyano-3-oxo-butyric acid ethyl ester,zlchem 939 |
| IUPAC Name | ethyl 2-cyano-3-oxobutanoate |
| InChI Key | NWOKVFOTWMZMHL-UHFFFAOYNA-N |
| Molecular Formula | C7H9NO3 |