Dicarbonyl Compounds

Organic compounds that contain two carbonyl functional groups; a carbonyl functional group consists of a carbon atom with a double bond to an oxygen atom (C=O).

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121 – 135 of 359 results

121

Dibutyl Malonate 99.0+%, TCI America™

CAS: 1190-39-2 Molecular Formula: C11H20O4 Molecular Weight (g/mol): 216.28 MDL Number: MFCD00053795 InChI Key: NFKGQHYUYGYHIS-UHFFFAOYSA-N Synonym: Malonic Acid Dibutyl Ester PubChem CID: 136925 IUPAC Name: 1,3-dibutyl propanedioate SMILES: CCCCOC(=O)CC(=O)OCCCC

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Specifications

PubChem CID	136925
CAS	1190-39-2
Molecular Weight (g/mol)	216.28
MDL Number	MFCD00053795
SMILES	CCCCOC(=O)CC(=O)OCCCC
Synonym	Malonic Acid Dibutyl Ester
IUPAC Name	1,3-dibutyl propanedioate
InChI Key	NFKGQHYUYGYHIS-UHFFFAOYSA-N
Molecular Formula	C11H20O4

122

Ethyl 3-Oxohexanoate 95.0+%, TCI America™

CAS: 3249-68-1 Molecular Formula: C8H14O3 Molecular Weight (g/mol): 158.20 MDL Number: MFCD00009401 InChI Key: KQWWVLVLVYYYDT-UHFFFAOYSA-N Synonym: ethyl butyrylacetate,ethyl butyroacetate,hexanoic acid, 3-oxo-, ethyl ester,ethyl beta-ketohexanoate,ethyl alpha-butyrylacetate,3-ketohexanoic acid ethyl ester,ethyl-3-oxohexanoate,unii-8q1ahg710e,ethyl .alpha.-butyrylacetate,fema no. 3683 PubChem CID: 238498 ChEBI: CHEBI:18119 IUPAC Name: ethyl 3-oxohexanoate SMILES: CCCC(=O)CC(=O)OCC

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Specifications

PubChem CID	238498
CAS	3249-68-1
Molecular Weight (g/mol)	158.20
ChEBI	CHEBI:18119
MDL Number	MFCD00009401
SMILES	CCCC(=O)CC(=O)OCC
Synonym	ethyl butyrylacetate,ethyl butyroacetate,hexanoic acid, 3-oxo-, ethyl ester,ethyl beta-ketohexanoate,ethyl alpha-butyrylacetate,3-ketohexanoic acid ethyl ester,ethyl-3-oxohexanoate,unii-8q1ahg710e,ethyl .alpha.-butyrylacetate,fema no. 3683
IUPAC Name	ethyl 3-oxohexanoate
InChI Key	KQWWVLVLVYYYDT-UHFFFAOYSA-N
Molecular Formula	C8H14O3

123

Hexyl Acetoacetate 97.0+%, TCI America™

CAS: 13562-84-0 Molecular Formula: C10H18O3 Molecular Weight (g/mol): 186.25 MDL Number: MFCD00059440 InChI Key: QNZLAXONNWOLJY-UHFFFAOYSA-N Synonym: Acetoacetic Acid Hexyl Ester PubChem CID: 83577 IUPAC Name: hexyl 3-oxobutanoate SMILES: CCCCCCOC(=O)CC(C)=O

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Specifications

PubChem CID	83577
CAS	13562-84-0
Molecular Weight (g/mol)	186.25
MDL Number	MFCD00059440
SMILES	CCCCCCOC(=O)CC(C)=O
Synonym	Acetoacetic Acid Hexyl Ester
IUPAC Name	hexyl 3-oxobutanoate
InChI Key	QNZLAXONNWOLJY-UHFFFAOYSA-N
Molecular Formula	C10H18O3

124

Ethyl 2-Methylacetoacetate 95.0+%, TCI America™

CAS: 609-14-3 Molecular Formula: C7H12O3 Molecular Weight (g/mol): 144.17 MDL Number: MFCD00009164 InChI Key: FNENWZWNOPCZGK-UHFFFAOYSA-N PubChem CID: 701 IUPAC Name: ethyl 2-methyl-3-oxobutanoate SMILES: CCOC(=O)C(C)C(=O)C

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Specifications

PubChem CID	701
CAS	609-14-3
Molecular Weight (g/mol)	144.17
MDL Number	MFCD00009164
SMILES	CCOC(=O)C(C)C(=O)C
IUPAC Name	ethyl 2-methyl-3-oxobutanoate
InChI Key	FNENWZWNOPCZGK-UHFFFAOYSA-N
Molecular Formula	C7H12O3

125

N,N-Dimethylacetoacetamide 97.0+%, TCI America™

CAS: 2044-64-6 Molecular Formula: C6H11NO2 Molecular Weight (g/mol): 129.159 MDL Number: MFCD00038243 InChI Key: YPEWWOUWRRQBAX-UHFFFAOYSA-N Synonym: n,n-dimethylacetoacetamide,butanamide, n,n-dimethyl-3-oxo,n,n-dimethyl-3-oxobutyramide,acetylacetamide, n,n-dimethyl,unii-7e2l0oaa4k,acetoacetamide, n,n-dimethyl,dimethylamid kyseliny acetoctove,dimethyl acetoacetamide,n,n-dimethyl acetoacetamide,nn-dimethylacetoacetamide PubChem CID: 16278 IUPAC Name: N,N-dimethyl-3-oxobutanamide SMILES: CC(=O)CC(=O)N(C)C

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Specifications

PubChem CID	16278
CAS	2044-64-6
Molecular Weight (g/mol)	129.159
MDL Number	MFCD00038243
SMILES	CC(=O)CC(=O)N(C)C
Synonym	n,n-dimethylacetoacetamide,butanamide, n,n-dimethyl-3-oxo,n,n-dimethyl-3-oxobutyramide,acetylacetamide, n,n-dimethyl,unii-7e2l0oaa4k,acetoacetamide, n,n-dimethyl,dimethylamid kyseliny acetoctove,dimethyl acetoacetamide,n,n-dimethyl acetoacetamide,nn-dimethylacetoacetamide
IUPAC Name	N,N-dimethyl-3-oxobutanamide
InChI Key	YPEWWOUWRRQBAX-UHFFFAOYSA-N
Molecular Formula	C6H11NO2

126

Diethyl Isopropylmalonate 98.0+%, TCI America™

CAS: 759-36-4 Molecular Formula: C10H18O4 Molecular Weight (g/mol): 202.25 MDL Number: MFCD00040491 InChI Key: BYQFBFWERHXONI-UHFFFAOYSA-N Synonym: diethyl isopropylmalonate,diethyl 2-isopropylmalonate,isopropyl diethyl malonate,1,3-diethyl 2-propan-2-yl propanedioate,diethylisopropylmalonate,isopropylmalonic acid diethyl ester,propanedioic acid, 1-methylethyl-, diethyl ester,ethyl isopropylmalonate,1,3-diethyl 2-isopropylpropanedioate,2-isopropyl-malonic acid diethyl ester PubChem CID: 12966 IUPAC Name: 1,3-diethyl 2-(propan-2-yl)propanedioate SMILES: CCOC(=O)C(C(C)C)C(=O)OCC

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Specifications

PubChem CID	12966
CAS	759-36-4
Molecular Weight (g/mol)	202.25
MDL Number	MFCD00040491
SMILES	CCOC(=O)C(C(C)C)C(=O)OCC
Synonym	diethyl isopropylmalonate,diethyl 2-isopropylmalonate,isopropyl diethyl malonate,1,3-diethyl 2-propan-2-yl propanedioate,diethylisopropylmalonate,isopropylmalonic acid diethyl ester,propanedioic acid, 1-methylethyl-, diethyl ester,ethyl isopropylmalonate,1,3-diethyl 2-isopropylpropanedioate,2-isopropyl-malonic acid diethyl ester
IUPAC Name	1,3-diethyl 2-(propan-2-yl)propanedioate
InChI Key	BYQFBFWERHXONI-UHFFFAOYSA-N
Molecular Formula	C10H18O4

127

Methyl 2-Oxocyclopentanecarboxylate 97.0+%, TCI America™

CAS: 10472-24-9 Molecular Formula: C7H10O3 Molecular Weight (g/mol): 142.154 MDL Number: MFCD00001411 InChI Key: PZBBESSUKAHBHD-UHFFFAOYSA-N Synonym: methyl 2-oxocyclopentanecarboxylate,methyl 2-cyclopentanonecarboxylate,2-carbmethoxycyclopentanone,methyl cyclopentanone-2-carboxylate,cyclopentanecarboxylic acid, 2-oxo-, methyl ester,2-methoxy carbonyl cyclopentanone,2-methoxycarbonylcyclopentanone,2-oxocyclopentanecarboxylic acid methyl ester,cyclopentanone-2-carboxylic acid methyl ester,mehyl-2-oxocyclopentane PubChem CID: 66328 IUPAC Name: methyl 2-oxocyclopentane-1-carboxylate SMILES: COC(=O)C1CCCC1=O

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Specifications

PubChem CID	66328
CAS	10472-24-9
Molecular Weight (g/mol)	142.154
MDL Number	MFCD00001411
SMILES	COC(=O)C1CCCC1=O
Synonym	methyl 2-oxocyclopentanecarboxylate,methyl 2-cyclopentanonecarboxylate,2-carbmethoxycyclopentanone,methyl cyclopentanone-2-carboxylate,cyclopentanecarboxylic acid, 2-oxo-, methyl ester,2-methoxy carbonyl cyclopentanone,2-methoxycarbonylcyclopentanone,2-oxocyclopentanecarboxylic acid methyl ester,cyclopentanone-2-carboxylic acid methyl ester,mehyl-2-oxocyclopentane
IUPAC Name	methyl 2-oxocyclopentane-1-carboxylate
InChI Key	PZBBESSUKAHBHD-UHFFFAOYSA-N
Molecular Formula	C7H10O3

128

sec-Butyl Acetoacetate 98.0+%, TCI America™

CAS: 13562-76-0 Molecular Formula: C8H14O3 Molecular Weight (g/mol): 158.197 MDL Number: MFCD00059392 InChI Key: QSTNBMLCULGCQE-UHFFFAOYSA-N Synonym: Acetoacetic Acid sec-Butyl Ester PubChem CID: 139498 IUPAC Name: butan-2-yl 3-oxobutanoate SMILES: CCC(C)OC(=O)CC(=O)C

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Specifications

PubChem CID	139498
CAS	13562-76-0
Molecular Weight (g/mol)	158.197
MDL Number	MFCD00059392
SMILES	CCC(C)OC(=O)CC(=O)C
Synonym	Acetoacetic Acid sec-Butyl Ester
IUPAC Name	butan-2-yl 3-oxobutanoate
InChI Key	QSTNBMLCULGCQE-UHFFFAOYSA-N
Molecular Formula	C8H14O3

129

Diisopropyl Malonate 99.0+%, TCI America™

CAS: 13195-64-7 Molecular Formula: C9H16O4 Molecular Weight (g/mol): 188.223 MDL Number: MFCD00059359 InChI Key: QRVSDVDFJFKYKA-UHFFFAOYSA-N Synonym: Malonic Acid Diisopropyl Ester PubChem CID: 83223 IUPAC Name: dipropan-2-yl propanedioate SMILES: CC(C)OC(=O)CC(=O)OC(C)C

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Specifications

PubChem CID	83223
CAS	13195-64-7
Molecular Weight (g/mol)	188.223
MDL Number	MFCD00059359
SMILES	CC(C)OC(=O)CC(=O)OC(C)C
Synonym	Malonic Acid Diisopropyl Ester
IUPAC Name	dipropan-2-yl propanedioate
InChI Key	QRVSDVDFJFKYKA-UHFFFAOYSA-N
Molecular Formula	C9H16O4

130

N,N-Diethylacetoacetamide 98.0+%, TCI America™

CAS: 2235-46-3 Molecular Formula: C8H15NO2 Molecular Weight (g/mol): 157.213 MDL Number: MFCD00026728 InChI Key: NTMXFHGYWJIAAE-UHFFFAOYSA-N Synonym: n,n-diethylacetoacetamide,n,n-diethyl-3-oxobutyramide,diethylacetoacetamide,butanamide, n,n-diethyl-3-oxo,acetoacetamide, n,n-diethyl,1-diethylcarbamoyl-2-propanone,n,n-diethylacetylacetamide,acetoacetdiethylamide,diethylamid kyseliny acetoctove,diethylamid kyseliny acetoctove czech PubChem CID: 16699 IUPAC Name: N,N-diethyl-3-oxobutanamide SMILES: CCN(CC)C(=O)CC(=O)C

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PubChem CID	16699
CAS	2235-46-3
Molecular Weight (g/mol)	157.213
MDL Number	MFCD00026728
SMILES	CCN(CC)C(=O)CC(=O)C
Synonym	n,n-diethylacetoacetamide,n,n-diethyl-3-oxobutyramide,diethylacetoacetamide,butanamide, n,n-diethyl-3-oxo,acetoacetamide, n,n-diethyl,1-diethylcarbamoyl-2-propanone,n,n-diethylacetylacetamide,acetoacetdiethylamide,diethylamid kyseliny acetoctove,diethylamid kyseliny acetoctove czech
IUPAC Name	N,N-diethyl-3-oxobutanamide
InChI Key	NTMXFHGYWJIAAE-UHFFFAOYSA-N
Molecular Formula	C8H15NO2

131

Diethyl 1,3-Acetonedicarboxylate 95.0+%, TCI America™

CAS: 105-50-0 Molecular Formula: C9H14O5 Molecular Weight (g/mol): 202.21 MDL Number: MFCD00009200 InChI Key: ZSANYRMTSBBUCA-UHFFFAOYSA-N Synonym: diethyl 1,3-acetonedicarboxylate,diethyl 3-oxoglutarate,1,5-diethyl 3-oxopentanedioate,pentanedioic acid, 3-oxo-, diethyl ester,ethyl acetonedicarboxylate,ethyl 3-oxoglutarate,diethyl acetone-1,3-dicarboxylate,diethyl acetone dicarboxylate,3-oxopentanedioic acid diethyl ester,acetonedicarboxylic acid diethyl ester PubChem CID: 66045 IUPAC Name: 1,5-diethyl 3-oxopentanedioate SMILES: CCOC(=O)CC(=O)CC(=O)OCC

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Specifications

PubChem CID	66045
CAS	105-50-0
Molecular Weight (g/mol)	202.21
MDL Number	MFCD00009200
SMILES	CCOC(=O)CC(=O)CC(=O)OCC
Synonym	diethyl 1,3-acetonedicarboxylate,diethyl 3-oxoglutarate,1,5-diethyl 3-oxopentanedioate,pentanedioic acid, 3-oxo-, diethyl ester,ethyl acetonedicarboxylate,ethyl 3-oxoglutarate,diethyl acetone-1,3-dicarboxylate,diethyl acetone dicarboxylate,3-oxopentanedioic acid diethyl ester,acetonedicarboxylic acid diethyl ester
IUPAC Name	1,5-diethyl 3-oxopentanedioate
InChI Key	ZSANYRMTSBBUCA-UHFFFAOYSA-N
Molecular Formula	C9H14O5

132

Diethyl Phenylmalonate 97.0+%, TCI America™

CAS: 83-13-6 Molecular Formula: C13H16O4 Molecular Weight (g/mol): 236.267 MDL Number: MFCD00009144 InChI Key: FGYDHYCFHBSNPE-UHFFFAOYSA-N Synonym: diethyl phenylmalonate,diethyl 2-phenylmalonate,phenylmalonic acid diethyl ester,propanedioic acid, phenyl-, diethyl ester,diethylphenylmalonate,1,3-diethyl 2-phenylpropanedioate,malonic acid, phenyl-, diethyl ester,propanedioic acid, 2-phenyl-, 1,3-diethyl ester,diethyl 2-phenylpropane-1,3-dioate,diethyl-phenylmalonate PubChem CID: 66514 IUPAC Name: diethyl 2-phenylpropanedioate SMILES: CCOC(=O)C(C1=CC=CC=C1)C(=O)OCC

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Specifications

PubChem CID	66514
CAS	83-13-6
Molecular Weight (g/mol)	236.267
MDL Number	MFCD00009144
SMILES	CCOC(=O)C(C1=CC=CC=C1)C(=O)OCC
Synonym	diethyl phenylmalonate,diethyl 2-phenylmalonate,phenylmalonic acid diethyl ester,propanedioic acid, phenyl-, diethyl ester,diethylphenylmalonate,1,3-diethyl 2-phenylpropanedioate,malonic acid, phenyl-, diethyl ester,propanedioic acid, 2-phenyl-, 1,3-diethyl ester,diethyl 2-phenylpropane-1,3-dioate,diethyl-phenylmalonate
IUPAC Name	diethyl 2-phenylpropanedioate
InChI Key	FGYDHYCFHBSNPE-UHFFFAOYSA-N
Molecular Formula	C13H16O4

133

Di-tert-butyl Malonate 98.0+%, TCI America™

CAS: 541-16-2 Molecular Formula: C11H20O4 Molecular Weight (g/mol): 216.277 MDL Number: MFCD00008810 InChI Key: CLPHAYNBNTVRDI-UHFFFAOYSA-N Synonym: di-tert-butyl malonate,malonic acid di-tert-butyl ester,propanedioic acid, bis 1,1-dimethylethyl ester,di-t-butylmalonate,di-t-butyl malonate,unii-7e9xwt9380,1,3-di-tert-butyl propanedioate,di tert-butyl malonate,tert-butyl 2-tert-butoxycarbonyl acetate,di-tert-butyl malonate, stab. with potassium carbonate PubChem CID: 68324 IUPAC Name: ditert-butyl propanedioate SMILES: CC(C)(C)OC(=O)CC(=O)OC(C)(C)C

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Specifications

PubChem CID	68324
CAS	541-16-2
Molecular Weight (g/mol)	216.277
MDL Number	MFCD00008810
SMILES	CC(C)(C)OC(=O)CC(=O)OC(C)(C)C
Synonym	di-tert-butyl malonate,malonic acid di-tert-butyl ester,propanedioic acid, bis 1,1-dimethylethyl ester,di-t-butylmalonate,di-t-butyl malonate,unii-7e9xwt9380,1,3-di-tert-butyl propanedioate,di tert-butyl malonate,tert-butyl 2-tert-butoxycarbonyl acetate,di-tert-butyl malonate, stab. with potassium carbonate
IUPAC Name	ditert-butyl propanedioate
InChI Key	CLPHAYNBNTVRDI-UHFFFAOYSA-N
Molecular Formula	C11H20O4

134

Ethyl 3-Oxovalerate 97.0+%, TCI America™

CAS: 4949-44-4 Molecular Formula: C7H12O3 Molecular Weight (g/mol): 144.17 MDL Number: MFCD00009317 InChI Key: UDRCONFHWYGWFI-UHFFFAOYSA-N Synonym: ethyl propionylacetate,ethyl 3-oxovalerate,ethyl 3-oxo-n-valerate,pentanoic acid, 3-oxo-, ethyl ester,3-oxopentanoic acid ethyl ester,3-oxo-pentanoic acid ethyl ester,ethyl 3-ketopentanoate,3-oxovaleric acid ethyl ester,propionylacetic acid ethyl ester,ethylpropanylacetate PubChem CID: 78656 IUPAC Name: ethyl 3-oxopentanoate SMILES: CCC(=O)CC(=O)OCC

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Specifications

PubChem CID	78656
CAS	4949-44-4
Molecular Weight (g/mol)	144.17
MDL Number	MFCD00009317
SMILES	CCC(=O)CC(=O)OCC
Synonym	ethyl propionylacetate,ethyl 3-oxovalerate,ethyl 3-oxo-n-valerate,pentanoic acid, 3-oxo-, ethyl ester,3-oxopentanoic acid ethyl ester,3-oxo-pentanoic acid ethyl ester,ethyl 3-ketopentanoate,3-oxovaleric acid ethyl ester,propionylacetic acid ethyl ester,ethylpropanylacetate
IUPAC Name	ethyl 3-oxopentanoate
InChI Key	UDRCONFHWYGWFI-UHFFFAOYSA-N
Molecular Formula	C7H12O3

135

Diethyl 3,3-Diethoxypropane-1,1-dicarboxylate 96.0+%, TCI America™

CAS: 21339-47-9 Molecular Formula: C13H24O6 Molecular Weight (g/mol): 276.329 MDL Number: MFCD00671525 InChI Key: VQUXMFKGQFXVBC-UHFFFAOYSA-N Synonym: 3,3-Diethoxypropane-1,1-dicarboxylic Acid Diethyl Ester PubChem CID: 298328 IUPAC Name: diethyl 2-(2,2-diethoxyethyl)propanedioate SMILES: CCOC(CC(C(=O)OCC)C(=O)OCC)OCC

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Specifications

PubChem CID	298328
CAS	21339-47-9
Molecular Weight (g/mol)	276.329
MDL Number	MFCD00671525
SMILES	CCOC(CC(C(=O)OCC)C(=O)OCC)OCC
Synonym	3,3-Diethoxypropane-1,1-dicarboxylic Acid Diethyl Ester
IUPAC Name	diethyl 2-(2,2-diethoxyethyl)propanedioate
InChI Key	VQUXMFKGQFXVBC-UHFFFAOYSA-N
Molecular Formula	C13H24O6

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