Carbonyl compounds
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Ethyl (4-Nitrobenzoyl)acetate 98.0+%, TCI America™
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CAS: 838-57-3 Molecular Formula: C11H11NO5 Molecular Weight (g/mol): 237.211 MDL Number: MFCD00007357 InChI Key: NGRXSVFCLHVGKU-UHFFFAOYSA-N Synonym: ethyl 4-nitrobenzoylacetate,ethyl 3-4-nitrophenyl-3-oxopropanoate,ethyl p-nitrobenzoyl acetate,ethyl 4-nitrobenzoyl acetate,p-nitrobenzoyl acetic acid ethyl ester,ethyl p-nitrobenzoylacetate,4-nitrobenzoylacetic acid ethyl ester,ethyl 4-nitro-beta-oxobenzenepropanoate,4-nitrobenzoyl acetic acid ethyl ester,benzenepropanoic acid, 4-nitro-beta-oxo-, ethyl ester PubChem CID: 13281 IUPAC Name: ethyl 3-(4-nitrophenyl)-3-oxopropanoate SMILES: CCOC(=O)CC(=O)C1=CC=C(C=C1)[N+](=O)[O-]
| PubChem CID | 13281 |
|---|---|
| CAS | 838-57-3 |
| Molecular Weight (g/mol) | 237.211 |
| MDL Number | MFCD00007357 |
| SMILES | CCOC(=O)CC(=O)C1=CC=C(C=C1)[N+](=O)[O-] |
| Synonym | ethyl 4-nitrobenzoylacetate,ethyl 3-4-nitrophenyl-3-oxopropanoate,ethyl p-nitrobenzoyl acetate,ethyl 4-nitrobenzoyl acetate,p-nitrobenzoyl acetic acid ethyl ester,ethyl p-nitrobenzoylacetate,4-nitrobenzoylacetic acid ethyl ester,ethyl 4-nitro-beta-oxobenzenepropanoate,4-nitrobenzoyl acetic acid ethyl ester,benzenepropanoic acid, 4-nitro-beta-oxo-, ethyl ester |
| IUPAC Name | ethyl 3-(4-nitrophenyl)-3-oxopropanoate |
| InChI Key | NGRXSVFCLHVGKU-UHFFFAOYSA-N |
| Molecular Formula | C11H11NO5 |
2'-Fluoropropiophenone 98.0+%, TCI America™
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CAS: 446-22-0 Molecular Formula: C9H9FO Molecular Weight (g/mol): 152.17 MDL Number: MFCD00009893 InChI Key: NSNSIFGTEGKZFK-UHFFFAOYSA-N Synonym: 2'-fluoropropiophenone,1-2-fluorophenyl propan-1-one,1-2-fluorophenyl-1-propanone,ethyl 2-fluorophenyl ketone,1-propanone, 1-2-fluorophenyl,1-2-fluorphenyl propan-1-on,2;-fluoropropiophenone,pubchem19917,acmc-1cpyw,o-fluoropropiophenone PubChem CID: 579399 IUPAC Name: 1-(2-fluorophenyl)propan-1-one SMILES: CCC(=O)C1=CC=CC=C1F
| PubChem CID | 579399 |
|---|---|
| CAS | 446-22-0 |
| Molecular Weight (g/mol) | 152.17 |
| MDL Number | MFCD00009893 |
| SMILES | CCC(=O)C1=CC=CC=C1F |
| Synonym | 2'-fluoropropiophenone,1-2-fluorophenyl propan-1-one,1-2-fluorophenyl-1-propanone,ethyl 2-fluorophenyl ketone,1-propanone, 1-2-fluorophenyl,1-2-fluorphenyl propan-1-on,2;-fluoropropiophenone,pubchem19917,acmc-1cpyw,o-fluoropropiophenone |
| IUPAC Name | 1-(2-fluorophenyl)propan-1-one |
| InChI Key | NSNSIFGTEGKZFK-UHFFFAOYSA-N |
| Molecular Formula | C9H9FO |
Undecanal 97.0+%, TCI America™
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CAS: 112-44-7 Molecular Formula: C11H22O Molecular Weight (g/mol): 170.296 MDL Number: MFCD00007016 InChI Key: KMPQYAYAQWNLME-UHFFFAOYSA-N Synonym: undecanaldehyde,n-undecanal,undecyl aldehyde,undecylic aldehyde,1-undecanal,undecylaldehyde,hendecanal,hendecanaldehyde,aldehyde c-11,n-undecyl aldehyde PubChem CID: 8186 ChEBI: CHEBI:46202 IUPAC Name: undecanal SMILES: CCCCCCCCCCC=O
| PubChem CID | 8186 |
|---|---|
| CAS | 112-44-7 |
| Molecular Weight (g/mol) | 170.296 |
| ChEBI | CHEBI:46202 |
| MDL Number | MFCD00007016 |
| SMILES | CCCCCCCCCCC=O |
| Synonym | undecanaldehyde,n-undecanal,undecyl aldehyde,undecylic aldehyde,1-undecanal,undecylaldehyde,hendecanal,hendecanaldehyde,aldehyde c-11,n-undecyl aldehyde |
| IUPAC Name | undecanal |
| InChI Key | KMPQYAYAQWNLME-UHFFFAOYSA-N |
| Molecular Formula | C11H22O |
7-Chloroisatin 98.0+%, TCI America™
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CAS: 7477-63-6 Molecular Formula: C8H4ClNO2 Molecular Weight (g/mol): 181.575 MDL Number: MFCD00022796 InChI Key: MPLXQMMMGDYXIT-UHFFFAOYSA-N Synonym: 7-chloroisatin,7-chloroindoline-2,3-dione,7-chloro-2,3-dihydro-1h-indole-2,3-dione,7-chloro-2,3-indolinedione,1h-indole-2,3-dione, 7-chloro,1h-indole-2,3-dione,7-chloro,7-chloro-1h-benzo d azolidine-2,3-dione,7-chlorisatin,7-chloro isatin,pubchem15537 PubChem CID: 344135 IUPAC Name: 7-chloro-1H-indole-2,3-dione SMILES: C1=CC2=C(C(=C1)Cl)NC(=O)C2=O
| PubChem CID | 344135 |
|---|---|
| CAS | 7477-63-6 |
| Molecular Weight (g/mol) | 181.575 |
| MDL Number | MFCD00022796 |
| SMILES | C1=CC2=C(C(=C1)Cl)NC(=O)C2=O |
| Synonym | 7-chloroisatin,7-chloroindoline-2,3-dione,7-chloro-2,3-dihydro-1h-indole-2,3-dione,7-chloro-2,3-indolinedione,1h-indole-2,3-dione, 7-chloro,1h-indole-2,3-dione,7-chloro,7-chloro-1h-benzo d azolidine-2,3-dione,7-chlorisatin,7-chloro isatin,pubchem15537 |
| IUPAC Name | 7-chloro-1H-indole-2,3-dione |
| InChI Key | MPLXQMMMGDYXIT-UHFFFAOYSA-N |
| Molecular Formula | C8H4ClNO2 |
3,3-Dimethyl-1-indanone 95.0+%, TCI America™
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CAS: 26465-81-6 Molecular Formula: C11H12O Molecular Weight (g/mol): 160.216 MDL Number: MFCD01846169 InChI Key: QWZAOSKLFKAEOK-UHFFFAOYSA-N PubChem CID: 304628 IUPAC Name: 3,3-dimethyl-2H-inden-1-one SMILES: CC1(CC(=O)C2=CC=CC=C21)C
| PubChem CID | 304628 |
|---|---|
| CAS | 26465-81-6 |
| Molecular Weight (g/mol) | 160.216 |
| MDL Number | MFCD01846169 |
| SMILES | CC1(CC(=O)C2=CC=CC=C21)C |
| IUPAC Name | 3,3-dimethyl-2H-inden-1-one |
| InChI Key | QWZAOSKLFKAEOK-UHFFFAOYSA-N |
| Molecular Formula | C11H12O |
2-Chlorocyclohexanone (stabilized with HQ + CaCO3) 96.0+%, TCI America™
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CAS: 822-87-7 Molecular Formula: C6H9ClO Molecular Weight (g/mol): 132.59 MDL Number: MFCD00001626 InChI Key: CCHNWURRBFGQCD-UHFFFAOYNA-N Synonym: 2-chlorocyclohexanone,cyclohexanone, 2-chloro,alpha-chlorocyclohexanone,2-chlorocyclohexonone,.alpha.-chlorocyclohexanone,2-chlorocyclohexanon,2-chlorocylohexanone,2-chloro cyclohexanone,2-chloro-cyclohexanone,acmc-209ted PubChem CID: 13203 IUPAC Name: 2-chlorocyclohexan-1-one SMILES: ClC1CCCCC1=O
| PubChem CID | 13203 |
|---|---|
| CAS | 822-87-7 |
| Molecular Weight (g/mol) | 132.59 |
| MDL Number | MFCD00001626 |
| SMILES | ClC1CCCCC1=O |
| Synonym | 2-chlorocyclohexanone,cyclohexanone, 2-chloro,alpha-chlorocyclohexanone,2-chlorocyclohexonone,.alpha.-chlorocyclohexanone,2-chlorocyclohexanon,2-chlorocylohexanone,2-chloro cyclohexanone,2-chloro-cyclohexanone,acmc-209ted |
| IUPAC Name | 2-chlorocyclohexan-1-one |
| InChI Key | CCHNWURRBFGQCD-UHFFFAOYNA-N |
| Molecular Formula | C6H9ClO |
trans-2-Methyl-2-pentenal 97.0+%, TCI America™
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CAS: 14250-96-5 Molecular Formula: C6H10O Molecular Weight (g/mol): 98.145 MDL Number: MFCD00006978 InChI Key: IDEYZABHVQLHAF-GQCTYLIASA-N PubChem CID: 5319754 IUPAC Name: (E)-2-methylpent-2-enal SMILES: CCC=C(C)C=O
| PubChem CID | 5319754 |
|---|---|
| CAS | 14250-96-5 |
| Molecular Weight (g/mol) | 98.145 |
| MDL Number | MFCD00006978 |
| SMILES | CCC=C(C)C=O |
| IUPAC Name | (E)-2-methylpent-2-enal |
| InChI Key | IDEYZABHVQLHAF-GQCTYLIASA-N |
| Molecular Formula | C6H10O |
Diethyl Allylmalonate 98.0+%, TCI America™
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CAS: 2049-80-1 Molecular Formula: C10H16O4 Molecular Weight (g/mol): 200.234 MDL Number: MFCD00009155 InChI Key: GDWAYKGILJJNBB-UHFFFAOYSA-N Synonym: diethyl allylmalonate,ethyl allylmalonate,diethyl 2-allylmalonate,allylmalonic acid diethyl ester,diethyl prop-2-enylpropanedioate,diethyl 2-prop-2-enyl malonate,malonic acid, allyl-, diethyl ester,propanedioic acid, 2-propenyl-, diethyl ester,diethyl 2-2-propenyl-1,3-propanedioate,allyl malonic acid PubChem CID: 74900 IUPAC Name: diethyl 2-prop-2-enylpropanedioate SMILES: CCOC(=O)C(CC=C)C(=O)OCC
| PubChem CID | 74900 |
|---|---|
| CAS | 2049-80-1 |
| Molecular Weight (g/mol) | 200.234 |
| MDL Number | MFCD00009155 |
| SMILES | CCOC(=O)C(CC=C)C(=O)OCC |
| Synonym | diethyl allylmalonate,ethyl allylmalonate,diethyl 2-allylmalonate,allylmalonic acid diethyl ester,diethyl prop-2-enylpropanedioate,diethyl 2-prop-2-enyl malonate,malonic acid, allyl-, diethyl ester,propanedioic acid, 2-propenyl-, diethyl ester,diethyl 2-2-propenyl-1,3-propanedioate,allyl malonic acid |
| IUPAC Name | diethyl 2-prop-2-enylpropanedioate |
| InChI Key | GDWAYKGILJJNBB-UHFFFAOYSA-N |
| Molecular Formula | C10H16O4 |
Methyl 3-Bromopyruvate 97.0+%, TCI America™
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CAS: 7425-63-0 Molecular Formula: C4H5BrO3 Molecular Weight (g/mol): 180.99 MDL Number: MFCD01862963 InChI Key: MQONVZMIFQQQHA-UHFFFAOYSA-N Synonym: 3-Bromo-2-oxopropionic Acid Methyl Ester, 3-Bromopyruvic Acid Methyl Ester, Methyl 3-Bromo-2-oxopropionate PubChem CID: 352524 IUPAC Name: methyl 3-bromo-2-oxopropanoate SMILES: COC(=O)C(=O)CBr
| PubChem CID | 352524 |
|---|---|
| CAS | 7425-63-0 |
| Molecular Weight (g/mol) | 180.99 |
| MDL Number | MFCD01862963 |
| SMILES | COC(=O)C(=O)CBr |
| Synonym | 3-Bromo-2-oxopropionic Acid Methyl Ester, 3-Bromopyruvic Acid Methyl Ester, Methyl 3-Bromo-2-oxopropionate |
| IUPAC Name | methyl 3-bromo-2-oxopropanoate |
| InChI Key | MQONVZMIFQQQHA-UHFFFAOYSA-N |
| Molecular Formula | C4H5BrO3 |
2',4'-Dihydroxyacetophenone 98.0+%, TCI America™
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CAS: 89-84-9 Molecular Formula: C8H8O3 Molecular Weight (g/mol): 152.15 MDL Number: MFCD00002279 InChI Key: SULYEHHGGXARJS-UHFFFAOYSA-N Synonym: 2',4'-dihydroxyacetophenone,2,4-dihydroxyacetophenone,1-2,4-dihydroxyphenyl ethanone,resacetophenone,4-acetylresorcinol,resoacetophenone,ethanone, 1-2,4-dihydroxyphenyl,1-acetyl-2,4-dihydroxybenzene,resorcinol, 4-acetyl,1-2,4-dihydroxyphenyl ethan-1-one PubChem CID: 6990 ChEBI: CHEBI:18414 IUPAC Name: 1-(2,4-dihydroxyphenyl)ethan-1-one SMILES: CC(=O)C1=CC=C(O)C=C1O
| PubChem CID | 6990 |
|---|---|
| CAS | 89-84-9 |
| Molecular Weight (g/mol) | 152.15 |
| ChEBI | CHEBI:18414 |
| MDL Number | MFCD00002279 |
| SMILES | CC(=O)C1=CC=C(O)C=C1O |
| Synonym | 2',4'-dihydroxyacetophenone,2,4-dihydroxyacetophenone,1-2,4-dihydroxyphenyl ethanone,resacetophenone,4-acetylresorcinol,resoacetophenone,ethanone, 1-2,4-dihydroxyphenyl,1-acetyl-2,4-dihydroxybenzene,resorcinol, 4-acetyl,1-2,4-dihydroxyphenyl ethan-1-one |
| IUPAC Name | 1-(2,4-dihydroxyphenyl)ethan-1-one |
| InChI Key | SULYEHHGGXARJS-UHFFFAOYSA-N |
| Molecular Formula | C8H8O3 |
Methyl Malonyl Chloride 97.0+%, TCI America™
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CAS: 37517-81-0 Molecular Formula: C4H5ClO3 Molecular Weight (g/mol): 136.531 MDL Number: MFCD00013657 InChI Key: UTBCRHAMJFMIIR-UHFFFAOYSA-N Synonym: methyl malonyl chloride,methyl 3-chloro-3-oxopropionate,methyl chloroformylacetate,propanoic acid, 3-chloro-3-oxo-, methyl ester,methyl-3-chloro-3-oxopropionate,methyl-3-chlor-3-oxopropanoat,methyl chlorocarbonylacetate,carbomethoxy acetyl chloride,methyl chloroformyl acetate,methyl3-chloro-3-oxopropionate PubChem CID: 123460 IUPAC Name: methyl 3-chloro-3-oxopropanoate SMILES: COC(=O)CC(=O)Cl
| PubChem CID | 123460 |
|---|---|
| CAS | 37517-81-0 |
| Molecular Weight (g/mol) | 136.531 |
| MDL Number | MFCD00013657 |
| SMILES | COC(=O)CC(=O)Cl |
| Synonym | methyl malonyl chloride,methyl 3-chloro-3-oxopropionate,methyl chloroformylacetate,propanoic acid, 3-chloro-3-oxo-, methyl ester,methyl-3-chloro-3-oxopropionate,methyl-3-chlor-3-oxopropanoat,methyl chlorocarbonylacetate,carbomethoxy acetyl chloride,methyl chloroformyl acetate,methyl3-chloro-3-oxopropionate |
| IUPAC Name | methyl 3-chloro-3-oxopropanoate |
| InChI Key | UTBCRHAMJFMIIR-UHFFFAOYSA-N |
| Molecular Formula | C4H5ClO3 |
4'-Chloro-2'-nitroacetophenone 98.0+%, TCI America™
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CAS: 23082-51-1 Molecular Formula: C8H6ClNO3 Molecular Weight (g/mol): 199.59 MDL Number: MFCD09031331 InChI Key: PUUYGMZERWRIDS-UHFFFAOYSA-N PubChem CID: 12643796 IUPAC Name: 1-(4-chloro-2-nitrophenyl)ethan-1-one SMILES: CC(=O)C1=C(C=C(Cl)C=C1)[N+]([O-])=O
| PubChem CID | 12643796 |
|---|---|
| CAS | 23082-51-1 |
| Molecular Weight (g/mol) | 199.59 |
| MDL Number | MFCD09031331 |
| SMILES | CC(=O)C1=C(C=C(Cl)C=C1)[N+]([O-])=O |
| IUPAC Name | 1-(4-chloro-2-nitrophenyl)ethan-1-one |
| InChI Key | PUUYGMZERWRIDS-UHFFFAOYSA-N |
| Molecular Formula | C8H6ClNO3 |
3,5-Diiodosalicylaldehyde 98.0+%, TCI America™
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CAS: 2631-77-8 Molecular Formula: C7H4I2O2 Molecular Weight (g/mol): 373.916 MDL Number: MFCD00003321 InChI Key: MYWSBJKVOUZCIA-UHFFFAOYSA-N Synonym: 3,5-diiodosalicylaldehyde,benzaldehyde, 2-hydroxy-3,5-diiodo,3,5-diiodo-2-hydroxybenzaldehyde,2-hydroxy-3,5-diiodo-benzaldehyde,acmc-20ancp,3,5-diodosolicylaldehyde,2,4-diiodo-6-formylphenol,#,benzaldehyde,2-hydroxy-3,5-diiodo PubChem CID: 75829 IUPAC Name: 2-hydroxy-3,5-diiodobenzaldehyde SMILES: C1=C(C=C(C(=C1I)O)C=O)I
| PubChem CID | 75829 |
|---|---|
| CAS | 2631-77-8 |
| Molecular Weight (g/mol) | 373.916 |
| MDL Number | MFCD00003321 |
| SMILES | C1=C(C=C(C(=C1I)O)C=O)I |
| Synonym | 3,5-diiodosalicylaldehyde,benzaldehyde, 2-hydroxy-3,5-diiodo,3,5-diiodo-2-hydroxybenzaldehyde,2-hydroxy-3,5-diiodo-benzaldehyde,acmc-20ancp,3,5-diodosolicylaldehyde,2,4-diiodo-6-formylphenol,#,benzaldehyde,2-hydroxy-3,5-diiodo |
| IUPAC Name | 2-hydroxy-3,5-diiodobenzaldehyde |
| InChI Key | MYWSBJKVOUZCIA-UHFFFAOYSA-N |
| Molecular Formula | C7H4I2O2 |
Cyclopropyl Phenyl Ketone 98.0+%, TCI America™
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CAS: 3481-02-5 Molecular Formula: C10H10O Molecular Weight (g/mol): 146.19 MDL Number: MFCD00001294 InChI Key: PJRHFTYXYCVOSJ-UHFFFAOYSA-N Synonym: cyclopropyl phenyl ketone,cyclopropyl phenyl methanone,phenyl cyclopropyl ketone,benzoylcyclopropane,methanone, cyclopropylphenyl,cyclopropylphenylketone,ketone, cyclopropyl phenyl,cyclopropyl-phenylmethanone,acmc-2097dl,cyclopropyl-phenyl-methanone PubChem CID: 77029 IUPAC Name: cyclopropyl(phenyl)methanone SMILES: C1CC1C(=O)C2=CC=CC=C2
| PubChem CID | 77029 |
|---|---|
| CAS | 3481-02-5 |
| Molecular Weight (g/mol) | 146.19 |
| MDL Number | MFCD00001294 |
| SMILES | C1CC1C(=O)C2=CC=CC=C2 |
| Synonym | cyclopropyl phenyl ketone,cyclopropyl phenyl methanone,phenyl cyclopropyl ketone,benzoylcyclopropane,methanone, cyclopropylphenyl,cyclopropylphenylketone,ketone, cyclopropyl phenyl,cyclopropyl-phenylmethanone,acmc-2097dl,cyclopropyl-phenyl-methanone |
| IUPAC Name | cyclopropyl(phenyl)methanone |
| InChI Key | PJRHFTYXYCVOSJ-UHFFFAOYSA-N |
| Molecular Formula | C10H10O |
3'-Bromo-4'-methylacetophenone 98.0+%, TCI America™
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CAS: 40180-80-1 Molecular Formula: C9H9BrO Molecular Weight (g/mol): 213.074 MDL Number: MFCD02683854 InChI Key: PDJLFESXPVLVMR-UHFFFAOYSA-N PubChem CID: 3309401 IUPAC Name: 1-(3-bromo-4-methylphenyl)ethanone SMILES: CC1=C(C=C(C=C1)C(=O)C)Br
| PubChem CID | 3309401 |
|---|---|
| CAS | 40180-80-1 |
| Molecular Weight (g/mol) | 213.074 |
| MDL Number | MFCD02683854 |
| SMILES | CC1=C(C=C(C=C1)C(=O)C)Br |
| IUPAC Name | 1-(3-bromo-4-methylphenyl)ethanone |
| InChI Key | PDJLFESXPVLVMR-UHFFFAOYSA-N |
| Molecular Formula | C9H9BrO |