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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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1 – 15 of 41 results
1

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

CAS: 7313-22-6 Molecular Formula: C7H14N2O2 Molecular Weight (g/mol): 158.201 MDL Number: MFCD03093641 InChI Key: AOXCXILUIVQCHH-UHFFFAOYSA-N PubChem CID: 10975767 IUPAC Name: N,N,N',N'-tetramethylpropanediamide SMILES: CN(C)C(=O)CC(=O)N(C)C

PubChem CID 10975767
CAS 7313-22-6
Molecular Weight (g/mol) 158.201
MDL Number MFCD03093641
SMILES CN(C)C(=O)CC(=O)N(C)C
IUPAC Name N,N,N',N'-tetramethylpropanediamide
InChI Key AOXCXILUIVQCHH-UHFFFAOYSA-N
Molecular Formula C7H14N2O2
2

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

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
3

Amyl Acetoacetate 98.0+%, TCI America™

CAS: 6624-84-6 Molecular Formula: C9H16O3 Molecular Weight (g/mol): 172.22 MDL Number: MFCD00059433 InChI Key: IDZAUPYMMSSVHP-UHFFFAOYSA-N Synonym: Acetoacetic Acid Pentyl Ester, Acetoacetic Acid Amyl Ester, Pentyl Acetoacetate PubChem CID: 138786 IUPAC Name: pentyl 3-oxobutanoate SMILES: CCCCCOC(=O)CC(C)=O

PubChem CID 138786
CAS 6624-84-6
Molecular Weight (g/mol) 172.22
MDL Number MFCD00059433
SMILES CCCCCOC(=O)CC(C)=O
Synonym Acetoacetic Acid Pentyl Ester, Acetoacetic Acid Amyl Ester, Pentyl Acetoacetate
IUPAC Name pentyl 3-oxobutanoate
InChI Key IDZAUPYMMSSVHP-UHFFFAOYSA-N
Molecular Formula C9H16O3
4

Butyl Acetoacetate 98.0+%, TCI America™

CAS: 591-60-6 Molecular Formula: C8H14O3 Molecular Weight (g/mol): 158.20 MDL Number: MFCD00059252 InChI Key: REIYHFWZISXFKU-UHFFFAOYSA-N Synonym: Acetoacetic Acid Butyl Ester PubChem CID: 11576 IUPAC Name: butyl 3-oxobutanoate SMILES: CCCCOC(=O)CC(C)=O

PubChem CID 11576
CAS 591-60-6
Molecular Weight (g/mol) 158.20
MDL Number MFCD00059252
SMILES CCCCOC(=O)CC(C)=O
Synonym Acetoacetic Acid Butyl Ester
IUPAC Name butyl 3-oxobutanoate
InChI Key REIYHFWZISXFKU-UHFFFAOYSA-N
Molecular Formula C8H14O3
5

Diethyl Propylmalonate 98.0+%, TCI America™

CAS: 2163-48-6 Molecular Formula: C10H18O4 Molecular Weight (g/mol): 202.25 MDL Number: MFCD00009168 InChI Key: GRRSDGHTSMJICM-UHFFFAOYSA-N Synonym: diethyl propylmalonate,diethyl 2-propylmalonate,1,3-diethyl 2-propylpropanedioate,diethyl n-propylmalonate,diethylpropylmalonate,propylmalonic acid diethyl ester,propanedioic acid, propyl-, diethyl ester,diethyl-n-propylmalonate,malonic acid, propyl-, diethyl ester,diethyl propyl malonate PubChem CID: 16552 IUPAC Name: diethyl 2-propylpropanedioate SMILES: CCCC(C(=O)OCC)C(=O)OCC

PubChem CID 16552
CAS 2163-48-6
Molecular Weight (g/mol) 202.25
MDL Number MFCD00009168
SMILES CCCC(C(=O)OCC)C(=O)OCC
Synonym diethyl propylmalonate,diethyl 2-propylmalonate,1,3-diethyl 2-propylpropanedioate,diethyl n-propylmalonate,diethylpropylmalonate,propylmalonic acid diethyl ester,propanedioic acid, propyl-, diethyl ester,diethyl-n-propylmalonate,malonic acid, propyl-, diethyl ester,diethyl propyl malonate
IUPAC Name diethyl 2-propylpropanedioate
InChI Key GRRSDGHTSMJICM-UHFFFAOYSA-N
Molecular Formula C10H18O4
6

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

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
7

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-]

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
8

Ethyl 2-Ethylacetoacetate 97.0+%, TCI America™

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
9

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

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
10

Diethyl phenylmalonate, 98%

CAS: 83-13-6 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

PubChem CID 66514
CAS 83-13-6
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
11

Di-tert-butyl malonate, 98+%, stab. with potassium carbonate

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

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
12

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
13

Benzyl tert-butyl malonate, 95%

CAS: 72594-86-6 Molecular Formula: C14H18O4 Molecular Weight (g/mol): 250.294 MDL Number: MFCD01075175 InChI Key: XKXXXODAXXAFNP-UHFFFAOYSA-N Synonym: benzyl tert-butyl malonate,benzyltert-butylmalonate,tert-butyl benzyl malonate,1-benzyl 3-tert-butyl propanedioate,tert-butyl 2-benzyloxycarbonyl acetate,propanedioic acid, 1,1-dimethylethyl phenylmethyl ester,tert-butyl phenylmethyl propane-1,3-dioate,pubchem3938,t-butyl benzyl malonate,ksc493q0n PubChem CID: 2736712 IUPAC Name: 1-O-benzyl 3-O-tert-butyl propanedioate SMILES: CC(C)(C)OC(=O)CC(=O)OCC1=CC=CC=C1

PubChem CID 2736712
CAS 72594-86-6
Molecular Weight (g/mol) 250.294
MDL Number MFCD01075175
SMILES CC(C)(C)OC(=O)CC(=O)OCC1=CC=CC=C1
Synonym benzyl tert-butyl malonate,benzyltert-butylmalonate,tert-butyl benzyl malonate,1-benzyl 3-tert-butyl propanedioate,tert-butyl 2-benzyloxycarbonyl acetate,propanedioic acid, 1,1-dimethylethyl phenylmethyl ester,tert-butyl phenylmethyl propane-1,3-dioate,pubchem3938,t-butyl benzyl malonate,ksc493q0n
IUPAC Name 1-O-benzyl 3-O-tert-butyl propanedioate
InChI Key XKXXXODAXXAFNP-UHFFFAOYSA-N
Molecular Formula C14H18O4
14

Dimethyl isobutylmalonate, 98%, Thermo Scientific™

CAS: 39520-24-6 Molecular Formula: C9H16O4 Molecular Weight (g/mol): 188.22 MDL Number: MFCD00015640 InChI Key: GAZFDPSEEIVCEX-UHFFFAOYSA-N Synonym: dimethyl isobutylmalonate,dimethyl 2-isobutylmalonate,dimethylisobutylmalonate,propanedioic acid, 2-2-methylpropyl-, 1,3-dimethyl ester,propanedioic acid, 2-methylpropyl-, dimethyl ester,1,3-dimethyl 2-2-methylpropyl propanedioate,malonic acid, isobutyl-, dimethyl ester,acmc-1ailj,dimethyl2-isobutylmalonate PubChem CID: 170218 IUPAC Name: dimethyl 2-(2-methylpropyl)propanedioate SMILES: COC(=O)C(CC(C)C)C(=O)OC

PubChem CID 170218
CAS 39520-24-6
Molecular Weight (g/mol) 188.22
MDL Number MFCD00015640
SMILES COC(=O)C(CC(C)C)C(=O)OC
Synonym dimethyl isobutylmalonate,dimethyl 2-isobutylmalonate,dimethylisobutylmalonate,propanedioic acid, 2-2-methylpropyl-, 1,3-dimethyl ester,propanedioic acid, 2-methylpropyl-, dimethyl ester,1,3-dimethyl 2-2-methylpropyl propanedioate,malonic acid, isobutyl-, dimethyl ester,acmc-1ailj,dimethyl2-isobutylmalonate
IUPAC Name dimethyl 2-(2-methylpropyl)propanedioate
InChI Key GAZFDPSEEIVCEX-UHFFFAOYSA-N
Molecular Formula C9H16O4
15

Benzyl ethyl malonate, tech. 85%

CAS: 42998-51-6 Molecular Formula: C12H14O4 Molecular Weight (g/mol): 222.24 MDL Number: MFCD00009194 InChI Key: CGNOCUSLPSCMLL-UHFFFAOYSA-N Synonym: benzyl ethyl malonate,benzylethyl malonate,malonic acid benzyl ethyl ester,ethyl benzylmalonate,acmc-20alpf,1-benzyl 3-ethyl malonate #,ethyl phenylmethyl propanedioate,1-benzyl 3-ethyl propanedioate,malonic acid 1-benzyl 3-ethyl ester,ethyl phenylmethyl propane-1,3-dioate PubChem CID: 562228 SMILES: CCOC(=O)CC(=O)OCC1=CC=CC=C1

PubChem CID 562228
CAS 42998-51-6
Molecular Weight (g/mol) 222.24
MDL Number MFCD00009194
SMILES CCOC(=O)CC(=O)OCC1=CC=CC=C1
Synonym benzyl ethyl malonate,benzylethyl malonate,malonic acid benzyl ethyl ester,ethyl benzylmalonate,acmc-20alpf,1-benzyl 3-ethyl malonate #,ethyl phenylmethyl propanedioate,1-benzyl 3-ethyl propanedioate,malonic acid 1-benzyl 3-ethyl ester,ethyl phenylmethyl propane-1,3-dioate
InChI Key CGNOCUSLPSCMLL-UHFFFAOYSA-N
Molecular Formula C12H14O4