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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166 – 180 of 353 results

166

Ethyl 2-Hexylacetoacetate 95.0+%, TCI America™

CAS: 29214-60-6 Molecular Formula: C12H22O3 Molecular Weight (g/mol): 214.305 MDL Number: MFCD00026889 InChI Key: BRGRZPQESQKATK-UHFFFAOYSA-N Synonym: 2-Acetyl-n-octanoic Acid Ethyl Ester, Ethyl 2-Acetyl-n-octanoate, Hexylacetoacetic Acid Ethyl Ester PubChem CID: 121790 IUPAC Name: ethyl 2-acetyloctanoate SMILES: CCCCCCC(C(=O)C)C(=O)OCC

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PubChem CID	121790
CAS	29214-60-6
Molecular Weight (g/mol)	214.305
MDL Number	MFCD00026889
SMILES	CCCCCCC(C(=O)C)C(=O)OCC
Synonym	2-Acetyl-n-octanoic Acid Ethyl Ester, Ethyl 2-Acetyl-n-octanoate, Hexylacetoacetic Acid Ethyl Ester
IUPAC Name	ethyl 2-acetyloctanoate
InChI Key	BRGRZPQESQKATK-UHFFFAOYSA-N
Molecular Formula	C12H22O3

167

Diethyl 3-Oxopimelate 96.0+%, TCI America™

CAS: 40420-22-2 Molecular Formula: C11H18O5 Molecular Weight (g/mol): 230.26 MDL Number: MFCD00009214 InChI Key: KAMXUPAAAGYEDK-UHFFFAOYSA-N Synonym: diethyl 3-oxopimelate,diethyl3-oxopimelate,heptanedioic acid, 3-oxo-, diethyl ester,1,7-diethyl 3-oxoheptanedioate,3-oxopimelic acid diethyl ester,diethyl3-oxoheptanedioate,acmc-1akc9,diethyl-3-oxopimelate,diethyl 3-oxoheptane-1,7-dioate PubChem CID: 575510 IUPAC Name: 1,5-diethyl 2,2-dimethyl-3-oxopentanedioate SMILES: CCOC(=O)CC(=O)C(C)(C)C(=O)OCC

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PubChem CID	575510
CAS	40420-22-2
Molecular Weight (g/mol)	230.26
MDL Number	MFCD00009214
SMILES	CCOC(=O)CC(=O)C(C)(C)C(=O)OCC
Synonym	diethyl 3-oxopimelate,diethyl3-oxopimelate,heptanedioic acid, 3-oxo-, diethyl ester,1,7-diethyl 3-oxoheptanedioate,3-oxopimelic acid diethyl ester,diethyl3-oxoheptanedioate,acmc-1akc9,diethyl-3-oxopimelate,diethyl 3-oxoheptane-1,7-dioate
IUPAC Name	1,5-diethyl 2,2-dimethyl-3-oxopentanedioate
InChI Key	KAMXUPAAAGYEDK-UHFFFAOYSA-N
Molecular Formula	C11H18O5

168

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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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

169

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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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

170

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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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

171

Allyl Acetoacetate 95.0+%, TCI America™

CAS: 1118-84-9 Molecular Formula: C7H10O3 Molecular Weight (g/mol): 142.154 MDL Number: MFCD00009811 InChI Key: AXLMPTNTPOWPLT-UHFFFAOYSA-N Synonym: allyl acetoacetate,allyl 3-oxobutanoate,allyl acetylacetate,acetoacetic acid, allyl ester,butanoic acid, 3-oxo-, 2-propenyl ester,prop-2-en-1-yl 3-oxobutanoate,acetoacetic acid allyl ester,2-propenyl 3-oxobutanoate,ac-allyl,unii-8hx066j62p PubChem CID: 70701 IUPAC Name: prop-2-enyl 3-oxobutanoate SMILES: CC(=O)CC(=O)OCC=C

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PubChem CID	70701
CAS	1118-84-9
Molecular Weight (g/mol)	142.154
MDL Number	MFCD00009811
SMILES	CC(=O)CC(=O)OCC=C
Synonym	allyl acetoacetate,allyl 3-oxobutanoate,allyl acetylacetate,acetoacetic acid, allyl ester,butanoic acid, 3-oxo-, 2-propenyl ester,prop-2-en-1-yl 3-oxobutanoate,acetoacetic acid allyl ester,2-propenyl 3-oxobutanoate,ac-allyl,unii-8hx066j62p
IUPAC Name	prop-2-enyl 3-oxobutanoate
InChI Key	AXLMPTNTPOWPLT-UHFFFAOYSA-N
Molecular Formula	C7H10O3

172

Benzyl Acetoacetate 95.0+%, TCI America™

CAS: 5396-89-4 Molecular Formula: C11H12O3 Molecular Weight (g/mol): 192.214 MDL Number: MFCD00008785 InChI Key: WOFAGNLBCJWEOE-UHFFFAOYSA-N Synonym: benzyl acetoacetate,acetoacetic acid benzyl ester,benzyl acetylacetate,acetoacetic acid, benzyl ester,phenylmethyl 3-oxobutanoate,butanoic acid, 3-oxo-, phenylmethyl ester,benzyl beta-ketobutyrate,ac-benzyl,unii-f9s0xgv18x,f9s0xgv18x PubChem CID: 142266 IUPAC Name: benzyl 3-oxobutanoate SMILES: CC(=O)CC(=O)OCC1=CC=CC=C1

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PubChem CID	142266
CAS	5396-89-4
Molecular Weight (g/mol)	192.214
MDL Number	MFCD00008785
SMILES	CC(=O)CC(=O)OCC1=CC=CC=C1
Synonym	benzyl acetoacetate,acetoacetic acid benzyl ester,benzyl acetylacetate,acetoacetic acid, benzyl ester,phenylmethyl 3-oxobutanoate,butanoic acid, 3-oxo-, phenylmethyl ester,benzyl beta-ketobutyrate,ac-benzyl,unii-f9s0xgv18x,f9s0xgv18x
IUPAC Name	benzyl 3-oxobutanoate
InChI Key	WOFAGNLBCJWEOE-UHFFFAOYSA-N
Molecular Formula	C11H12O3

173

Dimethyl Benzylmalonate 95.0+%, TCI America™

CAS: 49769-78-0 Molecular Formula: C12H14O4 Molecular Weight (g/mol): 222.24 MDL Number: MFCD01445471 InChI Key: ZMYJSOIMFGAQRQ-UHFFFAOYSA-N Synonym: Benzylmalonic Acid Dimethyl Ester PubChem CID: 10900856 IUPAC Name: 1,3-dimethyl 2-benzylpropanedioate SMILES: COC(=O)C(CC1=CC=CC=C1)C(=O)OC

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PubChem CID	10900856
CAS	49769-78-0
Molecular Weight (g/mol)	222.24
MDL Number	MFCD01445471
SMILES	COC(=O)C(CC1=CC=CC=C1)C(=O)OC
Synonym	Benzylmalonic Acid Dimethyl Ester
IUPAC Name	1,3-dimethyl 2-benzylpropanedioate
InChI Key	ZMYJSOIMFGAQRQ-UHFFFAOYSA-N
Molecular Formula	C12H14O4

174

Dibenzyl Malonate 95.0+%, TCI America™

CAS: 15014-25-2 Molecular Formula: C17H16O4 Molecular Weight (g/mol): 284.311 MDL Number: MFCD00004779 InChI Key: RYFCSKVXWRJEOB-UHFFFAOYSA-N PubChem CID: 84754 IUPAC Name: dibenzyl propanedioate SMILES: C1=CC=C(C=C1)COC(=O)CC(=O)OCC2=CC=CC=C2

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PubChem CID	84754
CAS	15014-25-2
Molecular Weight (g/mol)	284.311
MDL Number	MFCD00004779
SMILES	C1=CC=C(C=C1)COC(=O)CC(=O)OCC2=CC=CC=C2
IUPAC Name	dibenzyl propanedioate
InChI Key	RYFCSKVXWRJEOB-UHFFFAOYSA-N
Molecular Formula	C17H16O4

175

Diethyl Benzylmalonate 98.0+%, TCI America™

CAS: 607-81-8 Molecular Formula: C14H18O4 Molecular Weight (g/mol): 250.294 MDL Number: MFCD00009166 InChI Key: ICZLTZWATFXDLP-UHFFFAOYSA-N Synonym: diethyl benzylmalonate,diethyl 2-benzylmalonate,benzylmalonic acid diethyl ester,propanedioic acid, phenylmethyl-, diethyl ester,unii-40y0x0xn6p,malonic acid, benzyl-, diethyl ester,malonic acid, 2-benzyl-, diethyl ester,diethyl benzyl malonate,1,3-diethyl 2-benzylpropanedioate,diethyl benzylpropanedioate PubChem CID: 69090 IUPAC Name: diethyl 2-benzylpropanedioate SMILES: CCOC(=O)C(CC1=CC=CC=C1)C(=O)OCC

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PubChem CID	69090
CAS	607-81-8
Molecular Weight (g/mol)	250.294
MDL Number	MFCD00009166
SMILES	CCOC(=O)C(CC1=CC=CC=C1)C(=O)OCC
Synonym	diethyl benzylmalonate,diethyl 2-benzylmalonate,benzylmalonic acid diethyl ester,propanedioic acid, phenylmethyl-, diethyl ester,unii-40y0x0xn6p,malonic acid, benzyl-, diethyl ester,malonic acid, 2-benzyl-, diethyl ester,diethyl benzyl malonate,1,3-diethyl 2-benzylpropanedioate,diethyl benzylpropanedioate
IUPAC Name	diethyl 2-benzylpropanedioate
InChI Key	ICZLTZWATFXDLP-UHFFFAOYSA-N
Molecular Formula	C14H18O4

176

3-Thiophenemalonic Acid 98.0+%, TCI America™

CAS: 21080-92-2 Molecular Formula: C7H4O4S Molecular Weight (g/mol): 184.17 MDL Number: MFCD00005469 InChI Key: GCOOGCQWQFRJEK-UHFFFAOYSA-L Synonym: 3-thiophenemalonic acid,3-thienylmalonic acid,2-thiophen-3-yl malonic acid,propanedioic acid, 3-thienyl,3-thiophene malonic acid,3-thienylpropanedioic acid,3-thienyl malonic acid,thiophene-3-malonic acid,2-3-thienyl malonic acid,2-3-thienyl propanedioic acid PubChem CID: 88782 IUPAC Name: 2-(thiophen-3-yl)propanedioate SMILES: [O-]C(=O)C(C([O-])=O)C1=CSC=C1

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PubChem CID	88782
CAS	21080-92-2
Molecular Weight (g/mol)	184.17
MDL Number	MFCD00005469
SMILES	[O-]C(=O)C(C([O-])=O)C1=CSC=C1
Synonym	3-thiophenemalonic acid,3-thienylmalonic acid,2-thiophen-3-yl malonic acid,propanedioic acid, 3-thienyl,3-thiophene malonic acid,3-thienylpropanedioic acid,3-thienyl malonic acid,thiophene-3-malonic acid,2-3-thienyl malonic acid,2-3-thienyl propanedioic acid
IUPAC Name	2-(thiophen-3-yl)propanedioate
InChI Key	GCOOGCQWQFRJEK-UHFFFAOYSA-L
Molecular Formula	C7H4O4S

177

Mono-4-nitrobenzyl Malonate 98.0+%, TCI America™

CAS: 77359-11-6 Molecular Formula: C10H9NO6 Molecular Weight (g/mol): 239.183 MDL Number: MFCD00191556 InChI Key: RIGFMUNSTCPGNP-UHFFFAOYSA-N Synonym: Malonic Acid Mono-4-nitrobenzyl Ester, 4-Nitrobenzyl Hydrogen Malonate PubChem CID: 592642 SMILES: C1=CC(=CC=C1COC(=O)CC(=O)O)[N+](=O)[O-]

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PubChem CID	592642
CAS	77359-11-6
Molecular Weight (g/mol)	239.183
MDL Number	MFCD00191556
SMILES	C1=CC(=CC=C1COC(=O)CC(=O)O)[N+](=O)[O-]
Synonym	Malonic Acid Mono-4-nitrobenzyl Ester, 4-Nitrobenzyl Hydrogen Malonate
InChI Key	RIGFMUNSTCPGNP-UHFFFAOYSA-N
Molecular Formula	C10H9NO6

178

N,N,N',N'-Tetraethylmalonamide 97.0+%, TCI America™

CAS: 33931-42-9 Molecular Formula: C11H22N2O2 Molecular Weight (g/mol): 214.309 MDL Number: MFCD06797171 InChI Key: RTHWPWJSSJEQNU-UHFFFAOYSA-N PubChem CID: 551770 IUPAC Name: N,N,N',N'-tetraethylpropanediamide SMILES: CCN(CC)C(=O)CC(=O)N(CC)CC

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PubChem CID	551770
CAS	33931-42-9
Molecular Weight (g/mol)	214.309
MDL Number	MFCD06797171
SMILES	CCN(CC)C(=O)CC(=O)N(CC)CC
IUPAC Name	N,N,N',N'-tetraethylpropanediamide
InChI Key	RTHWPWJSSJEQNU-UHFFFAOYSA-N
Molecular Formula	C11H22N2O2

179

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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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

180

Sigma Aldrich 4-Morpholin-4-ylbutanoic acid

MilliporeSigma Sigma Organics products encompass a wide range of quality reagents, solvents, catalysts, and building blocks for organic synthesis. From benchtop discovery to process development and scale-up, Sigma Organics solutions are built to meet the needs of synthetic chemists.

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CAS	5807-09-0

Dicarbonyl Compounds

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