Complex Ketones

Organic compounds that contain one or more ketone functional groups; a ketone functional group consists of a carbonyl with a carbon atom, or other functional group adjacent to each side.

1 – 15 of 2,802 results

2-Acetylfuran, 99%

CAS: 1192-62-7 Molecular Formula: C₆H₆O₂ Molecular Weight (g/mol): 110.11 MDL Number: MFCD00003242 InChI Key: IEMMBWWQXVXBEU-UHFFFAOYSA-N Synonym: 2-acetylfuran,acetylfuran,1-furan-2-yl ethanone,2-furyl methyl ketone,methyl 2-furyl ketone,1-2-furyl ethanone,2-furylethanone,2-acetyl furan,ketone, 2-furyl methyl,ethanone, 1-2-furanyl PubChem CID: 14505 ChEBI: CHEBI:59983 IUPAC Name: 1-(furan-2-yl)ethanone SMILES: CC(=O)C1=CC=CO1

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Specifications

PubChem CID	14505
CAS	1192-62-7
Molecular Weight (g/mol)	110.11
ChEBI	CHEBI:59983
MDL Number	MFCD00003242
SMILES	CC(=O)C1=CC=CO1
Synonym	2-acetylfuran,acetylfuran,1-furan-2-yl ethanone,2-furyl methyl ketone,methyl 2-furyl ketone,1-2-furyl ethanone,2-furylethanone,2-acetyl furan,ketone, 2-furyl methyl,ethanone, 1-2-furanyl
IUPAC Name	1-(furan-2-yl)ethanone
InChI Key	IEMMBWWQXVXBEU-UHFFFAOYSA-N
Molecular Formula	C₆H₆O₂

2-Fluorophenacyl bromide, 98%

CAS: 655-15-2 Molecular Formula: C₈H₆BrFO Molecular Weight (g/mol): 217.04 InChI Key: QDNWNJSLWKHNTM-UHFFFAOYSA-N Synonym: 2-bromo-2'-fluoroacetophenone,2-bromo-1-2-fluorophenyl ethanone,2-fluorophenacyl bromide,2-bromo-1-2-fluorophenyl ethan-1-one,alpha-bromo-2-fluoroacetophenone,2-fluorophenacylbromide,ethanone, 2-bromo-1-2-fluorophenyl,o-fluorophenacyl bromide,omega-bromo-2-fluoroacetophenone,2-bromo-1-2'-fluorophenyl ethanone PubChem CID: 2737449 IUPAC Name: 2-bromo-1-(2-fluorophenyl)ethanone SMILES: C1=CC=C(C(=C1)C(=O)CBr)F

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Specifications

PubChem CID	2737449
CAS	655-15-2
Molecular Weight (g/mol)	217.04
SMILES	C1=CC=C(C(=C1)C(=O)CBr)F
Synonym	2-bromo-2'-fluoroacetophenone,2-bromo-1-2-fluorophenyl ethanone,2-fluorophenacyl bromide,2-bromo-1-2-fluorophenyl ethan-1-one,alpha-bromo-2-fluoroacetophenone,2-fluorophenacylbromide,ethanone, 2-bromo-1-2-fluorophenyl,o-fluorophenacyl bromide,omega-bromo-2-fluoroacetophenone,2-bromo-1-2'-fluorophenyl ethanone
IUPAC Name	2-bromo-1-(2-fluorophenyl)ethanone
InChI Key	QDNWNJSLWKHNTM-UHFFFAOYSA-N
Molecular Formula	C₈H₆BrFO

L-Kynurenine

CAS: 2922-83-0 Molecular Formula: C10H12N2O3 Molecular Weight (g/mol): 208.22 MDL Number: MFCD00069912 InChI Key: YGPSJZOEDVAXAB-QMMMGPOBSA-N Synonym: l-kynurenine,s-2-amino-4-2-aminophenyl-4-oxobutanoic acid,kynurenine, l,3-anthraniloyl-l-alanine,unii-02jw4j5r44,ccris 4425,2s-2-amino-4-2-aminophenyl-4-oxobutanoic acid,quinurenine,kynurenin,s-alpha,2-diamino-gamma-oxobenzenebutanoic acid PubChem CID: 161166 ChEBI: CHEBI:16946 IUPAC Name: (2S)-2-amino-4-(2-aminophenyl)-4-oxobutanoic acid SMILES: N[C@@H](CC(=O)C1=CC=CC=C1N)C(O)=O

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Specifications

PubChem CID	161166
CAS	2922-83-0
Molecular Weight (g/mol)	208.22
ChEBI	CHEBI:16946
MDL Number	MFCD00069912
SMILES	N[C@@H](CC(=O)C1=CC=CC=C1N)C(O)=O
Synonym	l-kynurenine,s-2-amino-4-2-aminophenyl-4-oxobutanoic acid,kynurenine, l,3-anthraniloyl-l-alanine,unii-02jw4j5r44,ccris 4425,2s-2-amino-4-2-aminophenyl-4-oxobutanoic acid,quinurenine,kynurenin,s-alpha,2-diamino-gamma-oxobenzenebutanoic acid
IUPAC Name	(2S)-2-amino-4-(2-aminophenyl)-4-oxobutanoic acid
InChI Key	YGPSJZOEDVAXAB-QMMMGPOBSA-N
Molecular Formula	C10H12N2O3

2-Acetylpyridine, 98%

CAS: 1122-62-9 Molecular Formula: C₇H₇NO Molecular Weight (g/mol): 121.14 InChI Key: AJKVQEKCUACUMD-UHFFFAOYSA-N Synonym: 2-acetylpyridine,1-pyridin-2-yl ethanone,methyl 2-pyridyl ketone,2-acetopyridine,2-pyridyl methyl ketone,acetylpyridine,ethanone, 1-2-pyridinyl,ketone, methyl 2-pyridyl,1-pyridin-2-yl ethan-1-one,1-2-pyridinyl ethanone PubChem CID: 14286 IUPAC Name: 1-pyridin-2-ylethanone SMILES: CC(=O)C1=CC=CC=N1

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Specifications

PubChem CID	14286
CAS	1122-62-9
Molecular Weight (g/mol)	121.14
SMILES	CC(=O)C1=CC=CC=N1
Synonym	2-acetylpyridine,1-pyridin-2-yl ethanone,methyl 2-pyridyl ketone,2-acetopyridine,2-pyridyl methyl ketone,acetylpyridine,ethanone, 1-2-pyridinyl,ketone, methyl 2-pyridyl,1-pyridin-2-yl ethan-1-one,1-2-pyridinyl ethanone
IUPAC Name	1-pyridin-2-ylethanone
InChI Key	AJKVQEKCUACUMD-UHFFFAOYSA-N
Molecular Formula	C₇H₇NO

1-Indanone, 99+%

CAS: 83-33-0 Molecular Formula: C₉H₈O Molecular Weight (g/mol): 132.16 InChI Key: QNXSIUBBGPHDDE-UHFFFAOYSA-N Synonym: 1-indanone,indan-1-one,2,3-dihydro-1h-inden-1-one,indanone,alpha-indanone,alpha-hydrindone,1h-inden-1-one, 2,3-dihydro,1-indone,hydrindone,.alpha.-indanone PubChem CID: 6735 ChEBI: CHEBI:17404 IUPAC Name: 2,3-dihydroinden-1-one SMILES: C1CC(=O)C2=CC=CC=C21

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Specifications

PubChem CID	6735
CAS	83-33-0
Molecular Weight (g/mol)	132.16
ChEBI	CHEBI:17404
SMILES	C1CC(=O)C2=CC=CC=C21
Synonym	1-indanone,indan-1-one,2,3-dihydro-1h-inden-1-one,indanone,alpha-indanone,alpha-hydrindone,1h-inden-1-one, 2,3-dihydro,1-indone,hydrindone,.alpha.-indanone
IUPAC Name	2,3-dihydroinden-1-one
InChI Key	QNXSIUBBGPHDDE-UHFFFAOYSA-N
Molecular Formula	C₉H₈O

L(-)-Sorbose, 98%

CAS: 87-79-6 MDL Number: MFCD00151097 InChI Key: BJHIKXHVCXFQLS-OTWZMJIISA-N Synonym: l---sorbose,3s,4r,5s-1,3,4,5,6-pentahydroxyhexan-2-one,sorbinose,keto-l-sorbose,esorben,sorbin,l--sorbose,hsdb 780,l-sorbinose,l-xylo-2-hexulose PubChem CID: 6904 ChEBI: CHEBI:13172 IUPAC Name: (3S,4R,5S)-1,3,4,5,6-pentahydroxyhexan-2-one SMILES: C(C(C(C(C(=O)CO)O)O)O)O

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Specifications

PubChem CID	6904
CAS	87-79-6
ChEBI	CHEBI:13172
MDL Number	MFCD00151097
SMILES	C(C(C(C(C(=O)CO)O)O)O)O
Synonym	l---sorbose,3s,4r,5s-1,3,4,5,6-pentahydroxyhexan-2-one,sorbinose,keto-l-sorbose,esorben,sorbin,l--sorbose,hsdb 780,l-sorbinose,l-xylo-2-hexulose
IUPAC Name	(3S,4R,5S)-1,3,4,5,6-pentahydroxyhexan-2-one
InChI Key	BJHIKXHVCXFQLS-OTWZMJIISA-N

Isatin, 98%

CAS: 91-56-5 Molecular Formula: C8H5NO2 Molecular Weight (g/mol): 147.133 MDL Number: MFCD00005718 InChI Key: JXDYKVIHCLTXOP-UHFFFAOYSA-N Synonym: isatin,indoline-2,3-dione,2,3-indolinedione,indole-2,3-dione,isatine,2,3-dioxoindoline,pseudoisatin,tribulin,isotin,isatic acid lactam PubChem CID: 7054 ChEBI: CHEBI:27539 IUPAC Name: 1H-indole-2,3-dione SMILES: C1=CC=C2C(=C1)C(=O)C(=O)N2

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Specifications

PubChem CID	7054
CAS	91-56-5
Molecular Weight (g/mol)	147.133
ChEBI	CHEBI:27539
MDL Number	MFCD00005718
SMILES	C1=CC=C2C(=C1)C(=O)C(=O)N2
Synonym	isatin,indoline-2,3-dione,2,3-indolinedione,indole-2,3-dione,isatine,2,3-dioxoindoline,pseudoisatin,tribulin,isotin,isatic acid lactam
IUPAC Name	1H-indole-2,3-dione
InChI Key	JXDYKVIHCLTXOP-UHFFFAOYSA-N
Molecular Formula	C8H5NO2

3',5'-Dimethoxy-4'-hydroxyacetophenone, 97%

CAS: 2478-38-8 Molecular Formula: C10H12O4 Molecular Weight (g/mol): 196.20 MDL Number: MFCD00008748 InChI Key: OJOBTAOGJIWAGB-UHFFFAOYSA-N Synonym: acetosyringone,3',5'-dimethoxy-4'-hydroxyacetophenone,1-4-hydroxy-3,5-dimethoxyphenyl ethanone,4'-hydroxy-3',5'-dimethoxyacetophenone,3,5-dimethoxy-4-hydroxyacetophenone,acetosyringon,ethanone, 1-4-hydroxy-3,5-dimethoxyphenyl,1-4-hydroxy-3,5-dimethoxyphenyl ethan-1-one,acetosyringenin,acetophenone, 4'-hydroxy-3',5'-dimethoxy PubChem CID: 17198 ChEBI: CHEBI:2404 IUPAC Name: 1-(4-hydroxy-3,5-dimethoxyphenyl)ethanone SMILES: COC1=CC(=CC(OC)=C1O)C(C)=O

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Specifications

PubChem CID	17198
CAS	2478-38-8
Molecular Weight (g/mol)	196.20
ChEBI	CHEBI:2404
MDL Number	MFCD00008748
SMILES	COC1=CC(=CC(OC)=C1O)C(C)=O
Synonym	acetosyringone,3',5'-dimethoxy-4'-hydroxyacetophenone,1-4-hydroxy-3,5-dimethoxyphenyl ethanone,4'-hydroxy-3',5'-dimethoxyacetophenone,3,5-dimethoxy-4-hydroxyacetophenone,acetosyringon,ethanone, 1-4-hydroxy-3,5-dimethoxyphenyl,1-4-hydroxy-3,5-dimethoxyphenyl ethan-1-one,acetosyringenin,acetophenone, 4'-hydroxy-3',5'-dimethoxy
IUPAC Name	1-(4-hydroxy-3,5-dimethoxyphenyl)ethanone
InChI Key	OJOBTAOGJIWAGB-UHFFFAOYSA-N
Molecular Formula	C10H12O4

3-(3-Methylphenyl)-3-oxopropanenitrile, 97%, Thermo Scientific™

CAS: 53882-81-8 Molecular Formula: C10H9NO Molecular Weight (g/mol): 159.188 MDL Number: MFCD00067922 InChI Key: IVLKDYOTZMFMLO-UHFFFAOYSA-N Synonym: 3-methylbenzoylacetonitrile,3-3-methylphenyl-3-oxopropanenitrile,3-toluoylacetonitrile,m-toluoylacetonitrile,3-oxo-3-m-tolyl propanenitrile,3-oxo-3-m-tolylpropanenitrile,pubchem12073,maybridge1_004502,acmc-1alb6,3-m-tolyl-3-oxo-propanenitrile PubChem CID: 143105 IUPAC Name: 3-(3-methylphenyl)-3-oxopropanenitrile SMILES: CC1=CC=CC(=C1)C(=O)CC#N

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Specifications

PubChem CID	143105
CAS	53882-81-8
Molecular Weight (g/mol)	159.188
MDL Number	MFCD00067922
SMILES	CC1=CC=CC(=C1)C(=O)CC#N
Synonym	3-methylbenzoylacetonitrile,3-3-methylphenyl-3-oxopropanenitrile,3-toluoylacetonitrile,m-toluoylacetonitrile,3-oxo-3-m-tolyl propanenitrile,3-oxo-3-m-tolylpropanenitrile,pubchem12073,maybridge1_004502,acmc-1alb6,3-m-tolyl-3-oxo-propanenitrile
IUPAC Name	3-(3-methylphenyl)-3-oxopropanenitrile
InChI Key	IVLKDYOTZMFMLO-UHFFFAOYSA-N
Molecular Formula	C10H9NO

2'-Chloro-5'-(trifluoromethyl)acetophenone, 96%

CAS: 71648-45-8 Molecular Formula: C9H6ClF3O Molecular Weight (g/mol): 222.591 MDL Number: MFCD00045092 InChI Key: YRGBMTWHOFQSDJ-UHFFFAOYSA-N Synonym: 2'-chloro-5'-trifluoromethyl acetophenone,1-2-chloro-5-trifluoromethyl phenyl ethanone,1-2-chloro-5-trifluoromethyl phenyl ethan-1-one,2-chloro-5-trifluoromethyl acetophenone,acetophenone, 2-chloro-5-trifluoromethyl,3-acetyl-4-chlorobenzotrifluoride,ethanone, 1-2-chloro-5-trifluoromethyl phenyl,1-acetyl-2-chloro-5-trifluoromethyl benzene,pubchem4210 PubChem CID: 144502 IUPAC Name: 1-[2-chloro-5-(trifluoromethyl)phenyl]ethanone SMILES: CC(=O)C1=C(C=CC(=C1)C(F)(F)F)Cl

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Specifications

PubChem CID	144502
CAS	71648-45-8
Molecular Weight (g/mol)	222.591
MDL Number	MFCD00045092
SMILES	CC(=O)C1=C(C=CC(=C1)C(F)(F)F)Cl
Synonym	2'-chloro-5'-trifluoromethyl acetophenone,1-2-chloro-5-trifluoromethyl phenyl ethanone,1-2-chloro-5-trifluoromethyl phenyl ethan-1-one,2-chloro-5-trifluoromethyl acetophenone,acetophenone, 2-chloro-5-trifluoromethyl,3-acetyl-4-chlorobenzotrifluoride,ethanone, 1-2-chloro-5-trifluoromethyl phenyl,1-acetyl-2-chloro-5-trifluoromethyl benzene,pubchem4210
IUPAC Name	1-[2-chloro-5-(trifluoromethyl)phenyl]ethanone
InChI Key	YRGBMTWHOFQSDJ-UHFFFAOYSA-N
Molecular Formula	C9H6ClF3O

1-(1-Benzothiophen-5-yl)-2-bromo-1-ethanone, 97%, Thermo Scientific™

CAS: 1131-87-9 Molecular Formula: C10H7BrOS Molecular Weight (g/mol): 255.13 MDL Number: MFCD07368508 InChI Key: NTQPGUCRHJHYIA-UHFFFAOYSA-N Synonym: 1-1-benzothiophen-5-yl-2-bromo-1-ethanone,1-1-benzothiophen-5-yl-2-bromoethanone,1-benzo b thiophen-5-yl-2-bromoethan-1-one,5-bromoacetylbenzo b thiophene,5-bromoacetyl-benzo b thiophene,5-bromoacetyl benzo b thiophene,ethanone,1-benzo b thien-5-yl-2-bromo,1-benzo b thiophen-5-yl-2-bromoethanone,1-1-benzothiophen-5-yl-2-bromoethan-1-one PubChem CID: 7060546 IUPAC Name: 1-(1-benzothiophen-5-yl)-2-bromoethanone SMILES: BrCC(=O)C1=CC=C2SC=CC2=C1

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Specifications

PubChem CID	7060546
CAS	1131-87-9
Molecular Weight (g/mol)	255.13
MDL Number	MFCD07368508
SMILES	BrCC(=O)C1=CC=C2SC=CC2=C1
Synonym	1-1-benzothiophen-5-yl-2-bromo-1-ethanone,1-1-benzothiophen-5-yl-2-bromoethanone,1-benzo b thiophen-5-yl-2-bromoethan-1-one,5-bromoacetylbenzo b thiophene,5-bromoacetyl-benzo b thiophene,5-bromoacetyl benzo b thiophene,ethanone,1-benzo b thien-5-yl-2-bromo,1-benzo b thiophen-5-yl-2-bromoethanone,1-1-benzothiophen-5-yl-2-bromoethan-1-one
IUPAC Name	1-(1-benzothiophen-5-yl)-2-bromoethanone
InChI Key	NTQPGUCRHJHYIA-UHFFFAOYSA-N
Molecular Formula	C10H7BrOS

2-Acetylbenzo[b]furan, 99%

CAS: 1646-26-0 Molecular Formula: C10H8O2 Molecular Weight (g/mol): 160.17 MDL Number: MFCD00005849 InChI Key: YUTFQTAITWWGFH-UHFFFAOYSA-N Synonym: 2-acetylbenzofuran,1-benzofuran-2-yl ethanone,ethanone, 1-2-benzofuranyl,benzofuran-2-yl methyl ketone,2-acetylcoumarone,2-acetylcumarone,2-benzofuranyl methyl ketone,benzo b furan-2-yl methyl ketone,1-2-benzofuranyl ethanone,2-acetylbenzo b furan PubChem CID: 15435 SMILES: CC(=O)C1=CC2=CC=CC=C2O1

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Specifications

PubChem CID	15435
CAS	1646-26-0
Molecular Weight (g/mol)	160.17
MDL Number	MFCD00005849
SMILES	CC(=O)C1=CC2=CC=CC=C2O1
Synonym	2-acetylbenzofuran,1-benzofuran-2-yl ethanone,ethanone, 1-2-benzofuranyl,benzofuran-2-yl methyl ketone,2-acetylcoumarone,2-acetylcumarone,2-benzofuranyl methyl ketone,benzo b furan-2-yl methyl ketone,1-2-benzofuranyl ethanone,2-acetylbenzo b furan
InChI Key	YUTFQTAITWWGFH-UHFFFAOYSA-N
Molecular Formula	C10H8O2

Acetone-1,3-dicarboxylic acid, 97%

CAS: 542-05-2 Molecular Formula: C5H6O5 Molecular Weight (g/mol): 146.098 MDL Number: MFCD00002711 InChI Key: OXTNCQMOKLOUAM-UHFFFAOYSA-N Synonym: 1,3-acetonedicarboxylic acid,3-oxoglutaric acid,acetonedicarboxylic acid,pentanedioic acid, 3-oxo,acetone-1,3-dicarboxylic acid,3-ketoglutaric acid,unii-ih7p7wo21p,1,3-acetonedicarboxylic acid; 3-ketoglutaric acid,ih7p7wo21p,acetondicarbonsaure PubChem CID: 68328 IUPAC Name: 3-oxopentanedioic acid SMILES: C(C(=O)CC(=O)O)C(=O)O

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Specifications

PubChem CID	68328
CAS	542-05-2
Molecular Weight (g/mol)	146.098
MDL Number	MFCD00002711
SMILES	C(C(=O)CC(=O)O)C(=O)O
Synonym	1,3-acetonedicarboxylic acid,3-oxoglutaric acid,acetonedicarboxylic acid,pentanedioic acid, 3-oxo,acetone-1,3-dicarboxylic acid,3-ketoglutaric acid,unii-ih7p7wo21p,1,3-acetonedicarboxylic acid; 3-ketoglutaric acid,ih7p7wo21p,acetondicarbonsaure
IUPAC Name	3-oxopentanedioic acid
InChI Key	OXTNCQMOKLOUAM-UHFFFAOYSA-N
Molecular Formula	C5H6O5

Thermo Scientific Chemicals D-Fructose, 99%

CAS: 57-48-7 Molecular Formula: C6H12O6 Molecular Weight (g/mol): 180.156 MDL Number: MFCD00148910 InChI Key: BJHIKXHVCXFQLS-UYFOZJQFSA-N Synonym: d---fructose,d--fructose,3s,4r,5r-1,3,4,5,6-pentahydroxyhexan-2-one,furucton,arabino-hexulose,keto-d-fructose,d-levulose,sugar, fruit,fructose, d,krystar 300 PubChem CID: 5984 ChEBI: CHEBI:48095 IUPAC Name: (3S,4R,5R)-1,3,4,5,6-pentahydroxyhexan-2-one SMILES: C(C(C(C(C(=O)CO)O)O)O)O

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Specifications

PubChem CID	5984
CAS	57-48-7
Molecular Weight (g/mol)	180.156
ChEBI	CHEBI:48095
MDL Number	MFCD00148910
SMILES	C(C(C(C(C(=O)CO)O)O)O)O
Synonym	d---fructose,d--fructose,3s,4r,5r-1,3,4,5,6-pentahydroxyhexan-2-one,furucton,arabino-hexulose,keto-d-fructose,d-levulose,sugar, fruit,fructose, d,krystar 300
IUPAC Name	(3S,4R,5R)-1,3,4,5,6-pentahydroxyhexan-2-one
InChI Key	BJHIKXHVCXFQLS-UYFOZJQFSA-N
Molecular Formula	C6H12O6

Ethyl bromopyruvate, 80-85%

CAS: 70-23-5 Molecular Formula: C5H7BrO3 Molecular Weight (g/mol): 195.01 MDL Number: MFCD00000204 InChI Key: VICYTAYPKBLQFB-UHFFFAOYSA-N Synonym: ethyl bromopyruvate,ethyl 3-bromopyruvate,propanoic acid, 3-bromo-2-oxo-, ethyl ester,bromopyruvic acid ethyl ester,ethyl bromo pyruvate,ethyl 3-bromo-2-oxopropionate,pyruvic acid, bromo-, ethyl ester,.beta.-bromopyruvic acid ethyl ester,3-bromo-2-oxo-propionic acid ethyl ester,beta-bromopyruvic acid ethyl ester PubChem CID: 66144 IUPAC Name: ethyl 3-bromo-2-oxopropanoate SMILES: CCOC(=O)C(=O)CBr

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Specifications

PubChem CID	66144
CAS	70-23-5
Molecular Weight (g/mol)	195.01
MDL Number	MFCD00000204
SMILES	CCOC(=O)C(=O)CBr
Synonym	ethyl bromopyruvate,ethyl 3-bromopyruvate,propanoic acid, 3-bromo-2-oxo-, ethyl ester,bromopyruvic acid ethyl ester,ethyl bromo pyruvate,ethyl 3-bromo-2-oxopropionate,pyruvic acid, bromo-, ethyl ester,.beta.-bromopyruvic acid ethyl ester,3-bromo-2-oxo-propionic acid ethyl ester,beta-bromopyruvic acid ethyl ester
IUPAC Name	ethyl 3-bromo-2-oxopropanoate
InChI Key	VICYTAYPKBLQFB-UHFFFAOYSA-N
Molecular Formula	C5H7BrO3

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