Carbonyl compounds
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Diethyl Isobutylmalonate 98.0+%, TCI America™
CAS: 10203-58-4 Molecular Formula: C11H20O4 Molecular Weight (g/mol): 216.277 MDL Number: MFCD00026869 InChI Key: OFRFGNSZCYDFOH-UHFFFAOYSA-N Synonym: diethyl isobutylmalonate,isobutylmalonic acid diethyl ester,diethyl 2-isobutylmalonate,propanedioic acid, 2-methylpropyl-, diethyl ester,malonic acid, isobutyl-, diethyl ester,diethyl 2-2-methylpropyl propanedioate,ethyl 2-carbethoxy-4-methyl pentanoate,propanedioic acid, 2-2-methylpropyl-, 1,3-diethyl ester,1,3-diethyl 2-2-methylpropyl propanedioate,diethylisobutylmalonate PubChem CID: 25047 IUPAC Name: diethyl 2-(2-methylpropyl)propanedioate SMILES: CCOC(=O)C(CC(C)C)C(=O)OCC
| PubChem CID | 25047 |
|---|---|
| CAS | 10203-58-4 |
| Molecular Weight (g/mol) | 216.277 |
| MDL Number | MFCD00026869 |
| SMILES | CCOC(=O)C(CC(C)C)C(=O)OCC |
| Synonym | diethyl isobutylmalonate,isobutylmalonic acid diethyl ester,diethyl 2-isobutylmalonate,propanedioic acid, 2-methylpropyl-, diethyl ester,malonic acid, isobutyl-, diethyl ester,diethyl 2-2-methylpropyl propanedioate,ethyl 2-carbethoxy-4-methyl pentanoate,propanedioic acid, 2-2-methylpropyl-, 1,3-diethyl ester,1,3-diethyl 2-2-methylpropyl propanedioate,diethylisobutylmalonate |
| IUPAC Name | diethyl 2-(2-methylpropyl)propanedioate |
| InChI Key | OFRFGNSZCYDFOH-UHFFFAOYSA-N |
| Molecular Formula | C11H20O4 |
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
| 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 |
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 |
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
| 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 |
Benzyl Methyl Malonate 96.0+%, TCI America™
CAS: 52267-39-7 Molecular Formula: C11H12O4 Molecular Weight (g/mol): 208.21 MDL Number: MFCD00008461 InChI Key: IAUZDBFOEWAQFE-UHFFFAOYSA-N Synonym: benzyl methyl malonate,1-benzyl 3-methyl propanedioate,malonic acid 1-benzyl 3-methyl ester,propanedioic acid, methyl phenylmethyl ester,benzylmethyl malonate,methyl benzyl malonate,acmc-1b0zd,benzyl methyl propanedioate,ksc493e1f PubChem CID: 572135 IUPAC Name: 1-benzyl 3-methyl propanedioate SMILES: COC(=O)CC(=O)OCC1=CC=CC=C1
| PubChem CID | 572135 |
|---|---|
| CAS | 52267-39-7 |
| Molecular Weight (g/mol) | 208.21 |
| MDL Number | MFCD00008461 |
| SMILES | COC(=O)CC(=O)OCC1=CC=CC=C1 |
| Synonym | benzyl methyl malonate,1-benzyl 3-methyl propanedioate,malonic acid 1-benzyl 3-methyl ester,propanedioic acid, methyl phenylmethyl ester,benzylmethyl malonate,methyl benzyl malonate,acmc-1b0zd,benzyl methyl propanedioate,ksc493e1f |
| IUPAC Name | 1-benzyl 3-methyl propanedioate |
| InChI Key | IAUZDBFOEWAQFE-UHFFFAOYSA-N |
| Molecular Formula | C11H12O4 |
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
| 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 |
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
| 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 |
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
| 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 |
Diethyl (5-Bromopentyl)malonate 97.0+%, TCI America™
CAS: 1906-95-2 Molecular Formula: C12H21BrO4 Molecular Weight (g/mol): 309.2 MDL Number: MFCD00048565 InChI Key: JZCAZGWJCVMTTQ-UHFFFAOYSA-N Synonym: (5-Bromopentyl)malonic Acid Diethyl Ester PubChem CID: 4401294 IUPAC Name: diethyl 2-(5-bromopentyl)propanedioate SMILES: CCOC(=O)C(CCCCCBr)C(=O)OCC
| PubChem CID | 4401294 |
|---|---|
| CAS | 1906-95-2 |
| Molecular Weight (g/mol) | 309.2 |
| MDL Number | MFCD00048565 |
| SMILES | CCOC(=O)C(CCCCCBr)C(=O)OCC |
| Synonym | (5-Bromopentyl)malonic Acid Diethyl Ester |
| IUPAC Name | diethyl 2-(5-bromopentyl)propanedioate |
| InChI Key | JZCAZGWJCVMTTQ-UHFFFAOYSA-N |
| Molecular Formula | C12H21BrO4 |
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
| 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 |
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
| 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 |
2-Benzoylthiophene 98.0+%, TCI America™
CAS: 135-00-2 Molecular Formula: C11H8OS Molecular Weight (g/mol): 188.244 MDL Number: MFCD00022495 InChI Key: DWYFUJJWTRPARQ-UHFFFAOYSA-N Synonym: 2-benzoylthiophene,phenyl thiophen-2-yl methanone,phenyl 2-thienyl ketone,methanone, phenyl-2-thienyl,ketone, phenyl 2-thienyl,phenyl 2-thienyl methanone,2-thienyl phenyl ketone,.alpha.-benzoylthiophene,phenyl-thiophen-2-yl-methanone,2-benzoyl thiophene PubChem CID: 67262 IUPAC Name: phenyl(thiophen-2-yl)methanone SMILES: C1=CC=C(C=C1)C(=O)C2=CC=CS2
| PubChem CID | 67262 |
|---|---|
| CAS | 135-00-2 |
| Molecular Weight (g/mol) | 188.244 |
| MDL Number | MFCD00022495 |
| SMILES | C1=CC=C(C=C1)C(=O)C2=CC=CS2 |
| Synonym | 2-benzoylthiophene,phenyl thiophen-2-yl methanone,phenyl 2-thienyl ketone,methanone, phenyl-2-thienyl,ketone, phenyl 2-thienyl,phenyl 2-thienyl methanone,2-thienyl phenyl ketone,.alpha.-benzoylthiophene,phenyl-thiophen-2-yl-methanone,2-benzoyl thiophene |
| IUPAC Name | phenyl(thiophen-2-yl)methanone |
| InChI Key | DWYFUJJWTRPARQ-UHFFFAOYSA-N |
| Molecular Formula | C11H8OS |
2-Acetyl-4-methylpyridine 98.0+%, TCI America™
CAS: 59576-26-0 Molecular Formula: C8H9NO Molecular Weight (g/mol): 135.166 MDL Number: MFCD01863638 InChI Key: HRVQMQWVGKYDCF-UHFFFAOYSA-N Synonym: 2-Acetyl-4-picoline PubChem CID: 564760 IUPAC Name: 1-(4-methylpyridin-2-yl)ethanone SMILES: CC1=CC(=NC=C1)C(=O)C
| PubChem CID | 564760 |
|---|---|
| CAS | 59576-26-0 |
| Molecular Weight (g/mol) | 135.166 |
| MDL Number | MFCD01863638 |
| SMILES | CC1=CC(=NC=C1)C(=O)C |
| Synonym | 2-Acetyl-4-picoline |
| IUPAC Name | 1-(4-methylpyridin-2-yl)ethanone |
| InChI Key | HRVQMQWVGKYDCF-UHFFFAOYSA-N |
| Molecular Formula | C8H9NO |
2,2-Dichloroacetophenone 97.0+%, TCI America™
CAS: 2648-61-5 Molecular Formula: C8H6Cl2O Molecular Weight (g/mol): 189.035 MDL Number: MFCD00000844 InChI Key: CERJZAHSUZVMCH-UHFFFAOYSA-N Synonym: 2,2-dichloroacetophenone,phenacylidene chloride,alpha,alpha-dichloroacetophenone,1,1-dichloroacetophenone,ethanone, 2,2-dichloro-1-phenyl,acetophenone, 2,2-dichloro,unii-3vj32jj8lh,.alpha.,.alpha.-dichloroacetophenone,3vj32jj8lh,2,2-dichloro-1-phenyl-ethanone PubChem CID: 72870 IUPAC Name: 2,2-dichloro-1-phenylethanone SMILES: C1=CC=C(C=C1)C(=O)C(Cl)Cl
| PubChem CID | 72870 |
|---|---|
| CAS | 2648-61-5 |
| Molecular Weight (g/mol) | 189.035 |
| MDL Number | MFCD00000844 |
| SMILES | C1=CC=C(C=C1)C(=O)C(Cl)Cl |
| Synonym | 2,2-dichloroacetophenone,phenacylidene chloride,alpha,alpha-dichloroacetophenone,1,1-dichloroacetophenone,ethanone, 2,2-dichloro-1-phenyl,acetophenone, 2,2-dichloro,unii-3vj32jj8lh,.alpha.,.alpha.-dichloroacetophenone,3vj32jj8lh,2,2-dichloro-1-phenyl-ethanone |
| IUPAC Name | 2,2-dichloro-1-phenylethanone |
| InChI Key | CERJZAHSUZVMCH-UHFFFAOYSA-N |
| Molecular Formula | C8H6Cl2O |
2-Benzoylpyridine 99.0+%, TCI America™
CAS: 91-02-1 Molecular Formula: C12H9NO Molecular Weight (g/mol): 183.21 MDL Number: MFCD00006300 InChI Key: GCSHUYKULREZSJ-UHFFFAOYSA-N Synonym: 2-benzoylpyridine,phenyl pyridin-2-yl methanone,phenyl 2-pyridyl ketone,methanone, phenyl-2-pyridinyl,pyridine, 2-benzoyl,2-pyridyl phenyl ketone,ketone, phenyl 2-pyridyl,phenyl 2-pyridinyl methanone,phenyl-a-pyridylketone,phenyl 2-pyridyl methanone PubChem CID: 7038 IUPAC Name: phenyl(pyridin-2-yl)methanone SMILES: C1=CC=C(C=C1)C(=O)C2=CC=CC=N2
| PubChem CID | 7038 |
|---|---|
| CAS | 91-02-1 |
| Molecular Weight (g/mol) | 183.21 |
| MDL Number | MFCD00006300 |
| SMILES | C1=CC=C(C=C1)C(=O)C2=CC=CC=N2 |
| Synonym | 2-benzoylpyridine,phenyl pyridin-2-yl methanone,phenyl 2-pyridyl ketone,methanone, phenyl-2-pyridinyl,pyridine, 2-benzoyl,2-pyridyl phenyl ketone,ketone, phenyl 2-pyridyl,phenyl 2-pyridinyl methanone,phenyl-a-pyridylketone,phenyl 2-pyridyl methanone |
| IUPAC Name | phenyl(pyridin-2-yl)methanone |
| InChI Key | GCSHUYKULREZSJ-UHFFFAOYSA-N |
| Molecular Formula | C12H9NO |