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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 de 78 résultats
1

Diethyl phenylmalonate, 98%

CAS: 83-13-6 Numéro MDL: MFCD00009144 Clé InChI: FGYDHYCFHBSNPE-UHFFFAOYSA-N Synonyme: 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 CID PubChem: 66514 Nom IUPAC: diethyl 2-phenylpropanedioate SMILES: CCOC(=O)C(C1=CC=CC=C1)C(=O)OCC

Synonyme 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
Numéro MDL MFCD00009144
CAS 83-13-6
CID PubChem 66514
Nom IUPAC diethyl 2-phenylpropanedioate
Clé InChI FGYDHYCFHBSNPE-UHFFFAOYSA-N
SMILES CCOC(=O)C(C1=CC=CC=C1)C(=O)OCC
2

Mono-Ethyl malonate, 95%

CAS: 1071-46-1 Formule moléculaire: C5H8O4 Poids moléculaire (g/mol): 132.11 Numéro MDL: MFCD00020490 Clé InChI: HGINADPHJQTSKN-UHFFFAOYSA-N Synonyme: ethyl hydrogen malonate,monoethyl malonate,monoethyl malonic acid,mono-ethyl malonate,monoethyl hydrogen malonate,malonic acid monoethyl ester,ethoxycarbonyl acetic acid,2-ethoxycarbonyl acetic acid,3-ethoxy-3-oxo-propanoic acid,ethylhydrogenmalonate CID PubChem: 70615 ChEBI: CHEBI:86907 Nom IUPAC: 3-ethoxy-3-oxopropanoic acid SMILES: CCOC(=O)CC(=O)O

Poids moléculaire (g/mol) 132.11
Synonyme ethyl hydrogen malonate,monoethyl malonate,monoethyl malonic acid,mono-ethyl malonate,monoethyl hydrogen malonate,malonic acid monoethyl ester,ethoxycarbonyl acetic acid,2-ethoxycarbonyl acetic acid,3-ethoxy-3-oxo-propanoic acid,ethylhydrogenmalonate
Numéro MDL MFCD00020490
CAS 1071-46-1
CID PubChem 70615
ChEBI CHEBI:86907
Nom IUPAC 3-ethoxy-3-oxopropanoic acid
Clé InChI HGINADPHJQTSKN-UHFFFAOYSA-N
SMILES CCOC(=O)CC(=O)O
Formule moléculaire C5H8O4
3

Ethyl isobutyrylacetate, 95%

CAS: 7152-15-0 Formule moléculaire: C8H14O3 Poids moléculaire (g/mol): 158.2 Numéro MDL: MFCD00009198 Clé InChI: XCLDSQRVMMXWMS-UHFFFAOYSA-N Synonyme: ethyl isobutyrylacetate,4-methyl-3-oxo-pentanoic acid ethyl ester,pentanoic acid, 4-methyl-3-oxo-, ethyl ester,ethyl isobutyroylacetate,valeric acid, 4-methyl-3-oxo-, ethyl ester,.gamma.,.gamma.-dimethylacetoacetic acid ethyl ester,beta-keto-gamma-methylvaleric acid ethyl ester,ethyl alpha-isobutyroylacetate,ethylisobutyrylacetate,ethyl iso-butyrylacetate CID PubChem: 81583 Nom IUPAC: ethyl 4-methyl-3-oxopentanoate SMILES: CCOC(=O)CC(=O)C(C)C

Poids moléculaire (g/mol) 158.2
Synonyme ethyl isobutyrylacetate,4-methyl-3-oxo-pentanoic acid ethyl ester,pentanoic acid, 4-methyl-3-oxo-, ethyl ester,ethyl isobutyroylacetate,valeric acid, 4-methyl-3-oxo-, ethyl ester,.gamma.,.gamma.-dimethylacetoacetic acid ethyl ester,beta-keto-gamma-methylvaleric acid ethyl ester,ethyl alpha-isobutyroylacetate,ethylisobutyrylacetate,ethyl iso-butyrylacetate
Numéro MDL MFCD00009198
CAS 7152-15-0
CID PubChem 81583
Nom IUPAC ethyl 4-methyl-3-oxopentanoate
Clé InChI XCLDSQRVMMXWMS-UHFFFAOYSA-N
SMILES CCOC(=O)CC(=O)C(C)C
Formule moléculaire C8H14O3
4

2-(4-Pyridyl)malondialdehyde, 95%

CAS: 51076-46-1 Formule moléculaire: C8H7NO2 Poids moléculaire (g/mol): 149.15 Numéro MDL: MFCD00216535 Clé InChI: RYYVVCNGQOENKM-UHFFFAOYSA-N Synonyme: 2-4-pyridyl malondialdehyde,2-pyridin-4-yl malonaldehyde,2-pyridin-4-yl propanedial,propanedial, 4-pyridinyl,2-4-pyridinyl malonaldehyde,2-pyridin-4-yl malondialdehyde,zlchem 842,2-4-pyridyl propanedial,ksc925a8h,2-4-pyridyl propane-1,3-dial CID PubChem: 2737246 Nom IUPAC: 2-pyridin-4-ylpropanedial SMILES: C1=CN=CC=C1C(C=O)C=O

Poids moléculaire (g/mol) 149.15
Synonyme 2-4-pyridyl malondialdehyde,2-pyridin-4-yl malonaldehyde,2-pyridin-4-yl propanedial,propanedial, 4-pyridinyl,2-4-pyridinyl malonaldehyde,2-pyridin-4-yl malondialdehyde,zlchem 842,2-4-pyridyl propanedial,ksc925a8h,2-4-pyridyl propane-1,3-dial
Numéro MDL MFCD00216535
CAS 51076-46-1
CID PubChem 2737246
Nom IUPAC 2-pyridin-4-ylpropanedial
Clé InChI RYYVVCNGQOENKM-UHFFFAOYSA-N
SMILES C1=CN=CC=C1C(C=O)C=O
Formule moléculaire C8H7NO2
5

Methyl 2-cyclopentanonecarboxylate, 96%

CAS: 10472-24-9 Formule moléculaire: C7H10O3 Poids moléculaire (g/mol): 142.15 Numéro MDL: MFCD00001411 Clé InChI: PZBBESSUKAHBHD-UHFFFAOYSA-N Synonyme: 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 CID PubChem: 66328 Nom IUPAC: methyl 2-oxocyclopentane-1-carboxylate SMILES: COC(=O)C1CCCC1=O

Poids moléculaire (g/mol) 142.15
Synonyme 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
Numéro MDL MFCD00001411
CAS 10472-24-9
CID PubChem 66328
Nom IUPAC methyl 2-oxocyclopentane-1-carboxylate
Clé InChI PZBBESSUKAHBHD-UHFFFAOYSA-N
SMILES COC(=O)C1CCCC1=O
Formule moléculaire C7H10O3
6

Ethyl propionylacetate, 98%

CAS: 4949-44-4 Formule moléculaire: C7H12O3 Poids moléculaire (g/mol): 144.17 Numéro MDL: MFCD00009317 Clé InChI: UDRCONFHWYGWFI-UHFFFAOYSA-N Synonyme: 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 CID PubChem: 78656 Nom IUPAC: ethyl 3-oxopentanoate SMILES: CCC(=O)CC(=O)OCC

Poids moléculaire (g/mol) 144.17
Synonyme 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
Numéro MDL MFCD00009317
CAS 4949-44-4
CID PubChem 78656
Nom IUPAC ethyl 3-oxopentanoate
Clé InChI UDRCONFHWYGWFI-UHFFFAOYSA-N
SMILES CCC(=O)CC(=O)OCC
Formule moléculaire C7H12O3
7

Mono-benzyl malonate, 95%

CAS: 40204-26-0 Formule moléculaire: C10H10O4 Poids moléculaire (g/mol): 194.19 Numéro MDL: MFCD00138132 Clé InChI: CFLAHQSWDKNWPW-UHFFFAOYSA-N Synonyme: mono-benzyl malonate,monobenzyl malonate,3-benzyloxy-3-oxopropanoic acid,benzyl hemimalonate,benzyl hydrogen malonate,monobenzylmalonate,2-benzyloxy carbonyl acetic acid,malonic acid monobenzyl ester,3-benzyl-oxy-3-oxopropanoic acid,propanedioic acid, 1-phenylmethyl ester CID PubChem: 181659 ChEBI: CHEBI:84093 Nom IUPAC: 3-oxo-3-phenylmethoxypropanoic acid SMILES: OC(=O)CC(=O)OCC1=CC=CC=C1

Poids moléculaire (g/mol) 194.19
Synonyme mono-benzyl malonate,monobenzyl malonate,3-benzyloxy-3-oxopropanoic acid,benzyl hemimalonate,benzyl hydrogen malonate,monobenzylmalonate,2-benzyloxy carbonyl acetic acid,malonic acid monobenzyl ester,3-benzyl-oxy-3-oxopropanoic acid,propanedioic acid, 1-phenylmethyl ester
Numéro MDL MFCD00138132
CAS 40204-26-0
CID PubChem 181659
ChEBI CHEBI:84093
Nom IUPAC 3-oxo-3-phenylmethoxypropanoic acid
Clé InChI CFLAHQSWDKNWPW-UHFFFAOYSA-N
SMILES OC(=O)CC(=O)OCC1=CC=CC=C1
Formule moléculaire C10H10O4
8

Dimethyl isobutylmalonate, 98%, Thermo Scientific™

CAS: 39520-24-6 Formule moléculaire: C9H16O4 Poids moléculaire (g/mol): 188.22 Numéro MDL: MFCD00015640 Clé InChI: GAZFDPSEEIVCEX-UHFFFAOYSA-N Synonyme: 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 CID PubChem: 170218 Nom IUPAC: dimethyl 2-(2-methylpropyl)propanedioate SMILES: COC(=O)C(CC(C)C)C(=O)OC

Poids moléculaire (g/mol) 188.22
Synonyme 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
Numéro MDL MFCD00015640
CAS 39520-24-6
CID PubChem 170218
Nom IUPAC dimethyl 2-(2-methylpropyl)propanedioate
Clé InChI GAZFDPSEEIVCEX-UHFFFAOYSA-N
SMILES COC(=O)C(CC(C)C)C(=O)OC
Formule moléculaire C9H16O4
9

Diethyl ethylmalonate, 99%

CAS: 133-13-1 Formule moléculaire: C9H16O4 Poids moléculaire (g/mol): 188.22 Numéro MDL: MFCD00009167 Clé InChI: VQAZCUCWHIIFGE-UHFFFAOYSA-N Synonyme: diethyl ethylmalonate,diethyl 2-ethylmalonate,propanedioic acid, ethyl-, diethyl ester,ethylmalonic acid diethyl ester,1,3-diethyl 2-ethylpropanedioate,unii-69g92oyr3m,propanedioic acid, 2-ethyl-, 1,3-diethyl ester,malonic acid, ethyl-, diethyl ester,diethyl ethylpropanedioate,diethyl 2-ethylpropane-1,3-dioate CID PubChem: 8610 Nom IUPAC: diethyl 2-ethylpropanedioate SMILES: CCC(C(=O)OCC)C(=O)OCC

Poids moléculaire (g/mol) 188.22
Synonyme diethyl ethylmalonate,diethyl 2-ethylmalonate,propanedioic acid, ethyl-, diethyl ester,ethylmalonic acid diethyl ester,1,3-diethyl 2-ethylpropanedioate,unii-69g92oyr3m,propanedioic acid, 2-ethyl-, 1,3-diethyl ester,malonic acid, ethyl-, diethyl ester,diethyl ethylpropanedioate,diethyl 2-ethylpropane-1,3-dioate
Numéro MDL MFCD00009167
CAS 133-13-1
CID PubChem 8610
Nom IUPAC diethyl 2-ethylpropanedioate
Clé InChI VQAZCUCWHIIFGE-UHFFFAOYSA-N
SMILES CCC(C(=O)OCC)C(=O)OCC
Formule moléculaire C9H16O4
10

Dimethyl malonate, 99+%

CAS: 108-59-8 Formule moléculaire: C5H8O4 Poids moléculaire (g/mol): 132.12 Numéro MDL: MFCD00008460 Clé InChI: BEPAFCGSDWSTEL-UHFFFAOYSA-N Synonyme: dimethyl malonate,methyl malonate,propanedioic acid, dimethyl ester,malonic acid dimethyl ester,1,3-dimethyl propanedioate,dimethyl 1,3-propanedioate,malonic acid, dimethyl ester,unii-em8y79998c,ccris 8981,propanedioic acid dimethyl ester CID PubChem: 7943 Nom IUPAC: dimethyl propanedioate SMILES: COC(=O)CC(=O)OC

Poids moléculaire (g/mol) 132.12
Synonyme dimethyl malonate,methyl malonate,propanedioic acid, dimethyl ester,malonic acid dimethyl ester,1,3-dimethyl propanedioate,dimethyl 1,3-propanedioate,malonic acid, dimethyl ester,unii-em8y79998c,ccris 8981,propanedioic acid dimethyl ester
Numéro MDL MFCD00008460
CAS 108-59-8
CID PubChem 7943
Nom IUPAC dimethyl propanedioate
Clé InChI BEPAFCGSDWSTEL-UHFFFAOYSA-N
SMILES COC(=O)CC(=O)OC
Formule moléculaire C5H8O4
11

Malonic acid, 99%

CAS: 141-82-2 Formule moléculaire: C3H4O4 Poids moléculaire (g/mol): 104.06 Clé InChI: OFOBLEOULBTSOW-UHFFFAOYSA-N Synonyme: malonic acid,dicarboxymethane,carboxyacetic acid,methanedicarboxylic acid,kyselina malonova,usaf ek-695,dicarboxylate,dicarboxylic acid,kyselina malonova czech,propanediolic acid CID PubChem: 867 ChEBI: CHEBI:30794 Nom IUPAC: propanedioic acid SMILES: C(C(=O)O)C(=O)O

Poids moléculaire (g/mol) 104.06
Synonyme malonic acid,dicarboxymethane,carboxyacetic acid,methanedicarboxylic acid,kyselina malonova,usaf ek-695,dicarboxylate,dicarboxylic acid,kyselina malonova czech,propanediolic acid
CAS 141-82-2
CID PubChem 867
ChEBI CHEBI:30794
Nom IUPAC propanedioic acid
Clé InChI OFOBLEOULBTSOW-UHFFFAOYSA-N
SMILES C(C(=O)O)C(=O)O
Formule moléculaire C3H4O4
12

Acetoacetamide, 97%

CAS: 5977-14-0 Clé InChI: GCPWJFKTWGFEHH-UHFFFAOYSA-N Synonyme: acetoacetamide,acetylacetamide,acetoacetic acid amide,butanamide, 3-oxo,3-oxobutanamid,unii-6o9u7cfy0t,6o9u7cfy0t,3-oxobutyramide,acmc-20alv9 CID PubChem: 80077 ChEBI: CHEBI:28515 Nom IUPAC: 3-oxobutanamide SMILES: CC(=O)CC(=O)N

Synonyme acetoacetamide,acetylacetamide,acetoacetic acid amide,butanamide, 3-oxo,3-oxobutanamid,unii-6o9u7cfy0t,6o9u7cfy0t,3-oxobutyramide,acmc-20alv9
CAS 5977-14-0
CID PubChem 80077
ChEBI CHEBI:28515
Nom IUPAC 3-oxobutanamide
Clé InChI GCPWJFKTWGFEHH-UHFFFAOYSA-N
SMILES CC(=O)CC(=O)N
13

Dimethyl 1,4-cyclohexanedione-2,5-dicarboxylate, 98+%

CAS: 6289-46-9 Formule moléculaire: C10H12O6 Poids moléculaire (g/mol): 228.20 Numéro MDL: MFCD00001607 Clé InChI: MHKKFFHWMKEBDW-UHFFFAOYNA-N Synonyme: dimethyl succinylsuccinate,dimethyl 1,4-cyclohexanedione-2,5-dicarboxylate,succinosuccinic acid, dimethyl ester,dmss,dimethyl succinylosuccinate,dimethyl 2,5-dioxo-1,4-cyclohexanedicarboxylate,dimethyl succinylo succinate,1,4-cyclohexanedicarboxylic acid, 2,5-dioxo-, dimethyl ester,2,5-dioxo-1,4-cyclohexanedicarboxylic acid dimethyl ester,1,4-cyclohexanedicarboxylic acid, 2,5-dioxo-, 1,4-dimethyl ester CID PubChem: 94866 Nom IUPAC: dimethyl 2,5-dioxocyclohexane-1,4-dicarboxylate SMILES: COC(=O)C1CC(=O)C(CC1=O)C(=O)OC

Poids moléculaire (g/mol) 228.20
Synonyme dimethyl succinylsuccinate,dimethyl 1,4-cyclohexanedione-2,5-dicarboxylate,succinosuccinic acid, dimethyl ester,dmss,dimethyl succinylosuccinate,dimethyl 2,5-dioxo-1,4-cyclohexanedicarboxylate,dimethyl succinylo succinate,1,4-cyclohexanedicarboxylic acid, 2,5-dioxo-, dimethyl ester,2,5-dioxo-1,4-cyclohexanedicarboxylic acid dimethyl ester,1,4-cyclohexanedicarboxylic acid, 2,5-dioxo-, 1,4-dimethyl ester
Numéro MDL MFCD00001607
CAS 6289-46-9
CID PubChem 94866
Nom IUPAC dimethyl 2,5-dioxocyclohexane-1,4-dicarboxylate
Clé InChI MHKKFFHWMKEBDW-UHFFFAOYNA-N
SMILES COC(=O)C1CC(=O)C(CC1=O)C(=O)OC
Formule moléculaire C10H12O6
14

Diethyl 1,3-acetonedicarboxylate, 95%

CAS: 105-50-0 Formule moléculaire: C9H14O5 Poids moléculaire (g/mol): 202.21 Numéro MDL: MFCD00009200 Clé InChI: ZSANYRMTSBBUCA-UHFFFAOYSA-N Synonyme: 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 CID PubChem: 66045 Nom IUPAC: diethyl 3-oxopentanedioate SMILES: CCOC(=O)CC(=O)CC(=O)OCC

Poids moléculaire (g/mol) 202.21
Synonyme 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
Numéro MDL MFCD00009200
CAS 105-50-0
CID PubChem 66045
Nom IUPAC diethyl 3-oxopentanedioate
Clé InChI ZSANYRMTSBBUCA-UHFFFAOYSA-N
SMILES CCOC(=O)CC(=O)CC(=O)OCC
Formule moléculaire C9H14O5
15

2-Bromomalonaldehyde, 97+%

CAS: 2065-75-0 Formule moléculaire: C3H3BrO2 Poids moléculaire (g/mol): 150.95 Clé InChI: SURMYNZXHKLDFO-UHFFFAOYSA-N Synonyme: 2-bromomalonaldehyde,bromomalonaldehyde,bromomalondialdehyde,propanedial, bromo,2-bromomalondialdehyde,2-bromo-1,3-propanedial,malonaldehyde, bromo,bromo-malonaldehyde,zlchem 220,2-bromo-malonaldehyde CID PubChem: 74945 Nom IUPAC: 2-bromopropanedial SMILES: C(=O)C(C=O)Br

Poids moléculaire (g/mol) 150.95
Synonyme 2-bromomalonaldehyde,bromomalonaldehyde,bromomalondialdehyde,propanedial, bromo,2-bromomalondialdehyde,2-bromo-1,3-propanedial,malonaldehyde, bromo,bromo-malonaldehyde,zlchem 220,2-bromo-malonaldehyde
CAS 2065-75-0
CID PubChem 74945
Nom IUPAC 2-bromopropanedial
Clé InChI SURMYNZXHKLDFO-UHFFFAOYSA-N
SMILES C(=O)C(C=O)Br
Formule moléculaire C3H3BrO2