Carbonyl compounds
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Acetaldehyde (ca. 2% in N,N-Dimethylformamide) [for Detection of Primary and Secondary Amines], TCI America™
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CAS: 75-07-0 Molecular Formula: C2H4O Molecular Weight (g/mol): 44.053 MDL Number: MFCD00006991 InChI Key: IKHGUXGNUITLKF-UHFFFAOYSA-N Synonym: ethanal,acetic aldehyde,ethyl aldehyde,acetaldehyd,acetylaldehyde,aldehyde,acetic ethanol,aldeide acetica,octowy aldehyd,aldehyde acetique PubChem CID: 177 ChEBI: CHEBI:15343 IUPAC Name: acetaldehyde SMILES: CC=O
| PubChem CID | 177 |
|---|---|
| CAS | 75-07-0 |
| Molecular Weight (g/mol) | 44.053 |
| ChEBI | CHEBI:15343 |
| MDL Number | MFCD00006991 |
| SMILES | CC=O |
| Synonym | ethanal,acetic aldehyde,ethyl aldehyde,acetaldehyd,acetylaldehyde,aldehyde,acetic ethanol,aldeide acetica,octowy aldehyd,aldehyde acetique |
| IUPAC Name | acetaldehyde |
| InChI Key | IKHGUXGNUITLKF-UHFFFAOYSA-N |
| Molecular Formula | C2H4O |
3'-Chloroacetophenone 97.0+%, TCI America™
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CAS: 99-02-5 Molecular Formula: C8H7ClO Molecular Weight (g/mol): 154.59 MDL Number: MFCD00000593 InChI Key: UUWJBXKHMMQDED-UHFFFAOYSA-N Synonym: 3'-chloroacetophenone,1-3-chlorophenyl ethanone,m-chloroacetophenone,ethanone, 1-3-chlorophenyl,3-chloroacetophenone,1-3-chlorophenyl ethan-1-one,3-chloro-acetophenone,acetophenone, 3'-chloro,1-3-chloro-phenyl-ethanone,3/'-chloroacetophenone PubChem CID: 14933 IUPAC Name: 1-(3-chlorophenyl)ethan-1-one SMILES: CC(=O)C1=CC=CC(Cl)=C1
| PubChem CID | 14933 |
|---|---|
| CAS | 99-02-5 |
| Molecular Weight (g/mol) | 154.59 |
| MDL Number | MFCD00000593 |
| SMILES | CC(=O)C1=CC=CC(Cl)=C1 |
| Synonym | 3'-chloroacetophenone,1-3-chlorophenyl ethanone,m-chloroacetophenone,ethanone, 1-3-chlorophenyl,3-chloroacetophenone,1-3-chlorophenyl ethan-1-one,3-chloro-acetophenone,acetophenone, 3'-chloro,1-3-chloro-phenyl-ethanone,3/'-chloroacetophenone |
| IUPAC Name | 1-(3-chlorophenyl)ethan-1-one |
| InChI Key | UUWJBXKHMMQDED-UHFFFAOYSA-N |
| Molecular Formula | C8H7ClO |
6-Chloro-3-pyridinecarboxaldehyde 96.0+%, TCI America™
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CAS: 23100-12-1 Molecular Formula: C6H4ClNO Molecular Weight (g/mol): 141.554 MDL Number: MFCD03095223 InChI Key: AFWWKZCPPRPDQK-UHFFFAOYSA-N Synonym: 6-chloronicotinaldehyde,2-chloropyridine-5-carbaldehyde,2-chloropyridine-5-carboxaldehyde,6-chloropyridine-3-carboxaldehyde,2-chloro-5-formylpyridine,6-chloro-pyridine-3-carbaldehyde,6-chloro-3-pyridinecarboxaldehyde,2-chloro-5-pyridine carbaldehyde,6-chloro-pyridin-3-carbaldehyde,2-chloro-5-pyridinecarboxaldehyde PubChem CID: 2764053 IUPAC Name: 6-chloropyridine-3-carbaldehyde SMILES: C1=CC(=NC=C1C=O)Cl
| PubChem CID | 2764053 |
|---|---|
| CAS | 23100-12-1 |
| Molecular Weight (g/mol) | 141.554 |
| MDL Number | MFCD03095223 |
| SMILES | C1=CC(=NC=C1C=O)Cl |
| Synonym | 6-chloronicotinaldehyde,2-chloropyridine-5-carbaldehyde,2-chloropyridine-5-carboxaldehyde,6-chloropyridine-3-carboxaldehyde,2-chloro-5-formylpyridine,6-chloro-pyridine-3-carbaldehyde,6-chloro-3-pyridinecarboxaldehyde,2-chloro-5-pyridine carbaldehyde,6-chloro-pyridin-3-carbaldehyde,2-chloro-5-pyridinecarboxaldehyde |
| IUPAC Name | 6-chloropyridine-3-carbaldehyde |
| InChI Key | AFWWKZCPPRPDQK-UHFFFAOYSA-N |
| Molecular Formula | C6H4ClNO |
2-Furoyltrifluoroacetone, TCI America™
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CAS: 326-90-9 Molecular Formula: C8H5F3O3 Molecular Weight (g/mol): 206.12 MDL Number: MFCD00020935 InChI Key: OWLPCALGCHDBCN-UHFFFAOYSA-N Synonym: 4,4,4-trifluoro-1-furan-2-yl butane-1,3-dione,2-furoyltrifluoroacetone,furoyltrifluoroacetone,4,4,4-trifluoro-1-2-furyl-1,3-butanedione,perfluoroacetyl 2-furoyl methane,furonyltrifluoroacetone,1,3-butanedione, 4,4,4-trifluoro-1-2-furanyl,4,4,4-trifluoro-1-2-furyl butane-1,3-dione,2-furoyl trifluoro acetone,4,4,4-trifluoro-1-2-furanyl-1,3-butanedione PubChem CID: 67594 IUPAC Name: 4,4,4-trifluoro-1-(furan-2-yl)butane-1,3-dione SMILES: FC(F)(F)C(=O)CC(=O)C1=CC=CO1
| PubChem CID | 67594 |
|---|---|
| CAS | 326-90-9 |
| Molecular Weight (g/mol) | 206.12 |
| MDL Number | MFCD00020935 |
| SMILES | FC(F)(F)C(=O)CC(=O)C1=CC=CO1 |
| Synonym | 4,4,4-trifluoro-1-furan-2-yl butane-1,3-dione,2-furoyltrifluoroacetone,furoyltrifluoroacetone,4,4,4-trifluoro-1-2-furyl-1,3-butanedione,perfluoroacetyl 2-furoyl methane,furonyltrifluoroacetone,1,3-butanedione, 4,4,4-trifluoro-1-2-furanyl,4,4,4-trifluoro-1-2-furyl butane-1,3-dione,2-furoyl trifluoro acetone,4,4,4-trifluoro-1-2-furanyl-1,3-butanedione |
| IUPAC Name | 4,4,4-trifluoro-1-(furan-2-yl)butane-1,3-dione |
| InChI Key | OWLPCALGCHDBCN-UHFFFAOYSA-N |
| Molecular Formula | C8H5F3O3 |
4'-Hexylacetophenone 96.0+%, TCI America™
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CAS: 37592-72-6 Molecular Formula: C14H20O Molecular Weight (g/mol): 204.313 MDL Number: MFCD00043677 InChI Key: WWBVHJKFJZBRSO-UHFFFAOYSA-N Synonym: p-hexylacetophenone,1-4-hexylphenyl ethanone,4'-hexylacetophenone,1-4-hexylphenyl ethan-1-one,4'-n-hexylacetophenone,ethanone, 1-4-hexylphenyl,4-n-hexylacetophenone,4-hexylacetophenone,1-acetyl-4-hexylbenzene,agarose gpg/le PubChem CID: 123462 IUPAC Name: 1-(4-hexylphenyl)ethanone SMILES: CCCCCCC1=CC=C(C=C1)C(=O)C
| PubChem CID | 123462 |
|---|---|
| CAS | 37592-72-6 |
| Molecular Weight (g/mol) | 204.313 |
| MDL Number | MFCD00043677 |
| SMILES | CCCCCCC1=CC=C(C=C1)C(=O)C |
| Synonym | p-hexylacetophenone,1-4-hexylphenyl ethanone,4'-hexylacetophenone,1-4-hexylphenyl ethan-1-one,4'-n-hexylacetophenone,ethanone, 1-4-hexylphenyl,4-n-hexylacetophenone,4-hexylacetophenone,1-acetyl-4-hexylbenzene,agarose gpg/le |
| IUPAC Name | 1-(4-hexylphenyl)ethanone |
| InChI Key | WWBVHJKFJZBRSO-UHFFFAOYSA-N |
| Molecular Formula | C14H20O |
Butyrophenone 99.0+%, TCI America™
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CAS: 495-40-9 Molecular Formula: C10H12O Molecular Weight (g/mol): 148.205 MDL Number: MFCD00009397 InChI Key: FFSAXUULYPJSKH-UHFFFAOYSA-N Synonym: butyrophenone,n-butyrophenone,1-butanone, 1-phenyl,phenyl propyl ketone,1-phenyl-1-butanone,propyl phenyl ketone,unii-186i11wb5b,1-phenyl-butan-1-one,propylphenylketone PubChem CID: 10315 IUPAC Name: 1-phenylbutan-1-one SMILES: CCCC(=O)C1=CC=CC=C1
| PubChem CID | 10315 |
|---|---|
| CAS | 495-40-9 |
| Molecular Weight (g/mol) | 148.205 |
| MDL Number | MFCD00009397 |
| SMILES | CCCC(=O)C1=CC=CC=C1 |
| Synonym | butyrophenone,n-butyrophenone,1-butanone, 1-phenyl,phenyl propyl ketone,1-phenyl-1-butanone,propyl phenyl ketone,unii-186i11wb5b,1-phenyl-butan-1-one,propylphenylketone |
| IUPAC Name | 1-phenylbutan-1-one |
| InChI Key | FFSAXUULYPJSKH-UHFFFAOYSA-N |
| Molecular Formula | C10H12O |
Phenylglyoxal Monohydrate 98.0+%, TCI America™
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CAS: 1075-06-5 Molecular Formula: C8H8O3 Molecular Weight (g/mol): 152.149 MDL Number: MFCD00149499 InChI Key: NBIBDIKAOBCFJN-UHFFFAOYSA-N Synonym: dihydroxyacetophenone,acetophenone, dihydroxy,dihydroxy 1-phenylethanone,2,2-dihydroxy-1-phenyl-ethanone,ethanone, 2,2-dihydroxy-1-phenyl,acetophenone, 2,2-dihydroxy,alpha,alpha-dihydroxyacetophenone,dioxyacetophenone,alpha,alpha-dihydroxy-acetophenone PubChem CID: 99611 IUPAC Name: 2,2-dihydroxy-1-phenylethanone SMILES: C1=CC=C(C=C1)C(=O)C(O)O
| PubChem CID | 99611 |
|---|---|
| CAS | 1075-06-5 |
| Molecular Weight (g/mol) | 152.149 |
| MDL Number | MFCD00149499 |
| SMILES | C1=CC=C(C=C1)C(=O)C(O)O |
| Synonym | dihydroxyacetophenone,acetophenone, dihydroxy,dihydroxy 1-phenylethanone,2,2-dihydroxy-1-phenyl-ethanone,ethanone, 2,2-dihydroxy-1-phenyl,acetophenone, 2,2-dihydroxy,alpha,alpha-dihydroxyacetophenone,dioxyacetophenone,alpha,alpha-dihydroxy-acetophenone |
| IUPAC Name | 2,2-dihydroxy-1-phenylethanone |
| InChI Key | NBIBDIKAOBCFJN-UHFFFAOYSA-N |
| Molecular Formula | C8H8O3 |
Undecanophenone 98.0+%, TCI America™
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CAS: 4433-30-1 Molecular Formula: C17H26O Molecular Weight (g/mol): 246.394 MDL Number: MFCD00051548 InChI Key: LHJBFOGCFZHBAJ-UHFFFAOYSA-N Synonym: undecanophenone,n-undecanophenone,1-phenylundecanone,1-undecanone, 1-phenyl,decyl phenyl ketone,1-phenyl-1-undecanone,1-phenyl-undecan-1-one,1-phenyl-1-undecanone #,acmc-209jx6 PubChem CID: 78167 IUPAC Name: 1-phenylundecan-1-one SMILES: CCCCCCCCCCC(=O)C1=CC=CC=C1
| PubChem CID | 78167 |
|---|---|
| CAS | 4433-30-1 |
| Molecular Weight (g/mol) | 246.394 |
| MDL Number | MFCD00051548 |
| SMILES | CCCCCCCCCCC(=O)C1=CC=CC=C1 |
| Synonym | undecanophenone,n-undecanophenone,1-phenylundecanone,1-undecanone, 1-phenyl,decyl phenyl ketone,1-phenyl-1-undecanone,1-phenyl-undecan-1-one,1-phenyl-1-undecanone #,acmc-209jx6 |
| IUPAC Name | 1-phenylundecan-1-one |
| InChI Key | LHJBFOGCFZHBAJ-UHFFFAOYSA-N |
| Molecular Formula | C17H26O |
Magnesium 4-Nitrobenzyl Malonate Hydrate, TCI America™
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CAS: 83972-01-4 Molecular Formula: C20H16MgN2O12 Molecular Weight (g/mol): 500.655 MDL Number: MFCD00060141 InChI Key: WAFDWKYNSTVECG-UHFFFAOYSA-L Synonym: Malonic Acid Mono-4-nitrobenzyl Ester Magnesium Salt PubChem CID: 13338668 IUPAC Name: magnesium;3-[(4-nitrophenyl)methoxy]-3-oxopropanoate SMILES: C1=CC(=CC=C1COC(=O)CC(=O)[O-])[N+](=O)[O-].C1=CC(=CC=C1COC(=O)CC(=O)[O-])[N+](=O)[O-].[Mg+2]
| PubChem CID | 13338668 |
|---|---|
| CAS | 83972-01-4 |
| Molecular Weight (g/mol) | 500.655 |
| MDL Number | MFCD00060141 |
| SMILES | C1=CC(=CC=C1COC(=O)CC(=O)[O-])[N+](=O)[O-].C1=CC(=CC=C1COC(=O)CC(=O)[O-])[N+](=O)[O-].[Mg+2] |
| Synonym | Malonic Acid Mono-4-nitrobenzyl Ester Magnesium Salt |
| IUPAC Name | magnesium;3-[(4-nitrophenyl)methoxy]-3-oxopropanoate |
| InChI Key | WAFDWKYNSTVECG-UHFFFAOYSA-L |
| Molecular Formula | C20H16MgN2O12 |
2'-Hydroxy-5'-methylacetophenone 98.0+%, TCI America™
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CAS: 1450-72-2 Molecular Formula: C9H10O2 Molecular Weight (g/mol): 150.177 MDL Number: MFCD00002380 InChI Key: YNPDFBFVMJNGKZ-UHFFFAOYSA-N Synonym: 2'-hydroxy-5'-methylacetophenone,1-2-hydroxy-5-methylphenyl ethanone,2-hydroxy-5-methylacetophenone,o-acetyl-p-cresol,ethanone, 1-2-hydroxy-5-methylphenyl,2-acetyl-4-methylphenol,1-2-hydroxy-5-methylphenyl ethan-1-one,1-hydroxy-2-acetyl-4-methylbenzene,1-2-hydroxy-5-methyl-phenyl-ethanone,unii-11661u1zen PubChem CID: 15068 IUPAC Name: 1-(2-hydroxy-5-methylphenyl)ethanone SMILES: CC1=CC(=C(C=C1)O)C(=O)C
| PubChem CID | 15068 |
|---|---|
| CAS | 1450-72-2 |
| Molecular Weight (g/mol) | 150.177 |
| MDL Number | MFCD00002380 |
| SMILES | CC1=CC(=C(C=C1)O)C(=O)C |
| Synonym | 2'-hydroxy-5'-methylacetophenone,1-2-hydroxy-5-methylphenyl ethanone,2-hydroxy-5-methylacetophenone,o-acetyl-p-cresol,ethanone, 1-2-hydroxy-5-methylphenyl,2-acetyl-4-methylphenol,1-2-hydroxy-5-methylphenyl ethan-1-one,1-hydroxy-2-acetyl-4-methylbenzene,1-2-hydroxy-5-methyl-phenyl-ethanone,unii-11661u1zen |
| IUPAC Name | 1-(2-hydroxy-5-methylphenyl)ethanone |
| InChI Key | YNPDFBFVMJNGKZ-UHFFFAOYSA-N |
| Molecular Formula | C9H10O2 |
2-Hydroxy-2-methylpropiophenone 96.0+%, TCI America™
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CAS: 7473-98-5 Molecular Formula: C10H12O2 Molecular Weight (g/mol): 164.204 MDL Number: MFCD00040710 InChI Key: XMLYCEVDHLAQEL-UHFFFAOYSA-N Synonym: 2-Benzoyl-2-propanol PubChem CID: 81984 IUPAC Name: 2-hydroxy-2-methyl-1-phenylpropan-1-one SMILES: CC(C)(C(=O)C1=CC=CC=C1)O
| PubChem CID | 81984 |
|---|---|
| CAS | 7473-98-5 |
| Molecular Weight (g/mol) | 164.204 |
| MDL Number | MFCD00040710 |
| SMILES | CC(C)(C(=O)C1=CC=CC=C1)O |
| Synonym | 2-Benzoyl-2-propanol |
| IUPAC Name | 2-hydroxy-2-methyl-1-phenylpropan-1-one |
| InChI Key | XMLYCEVDHLAQEL-UHFFFAOYSA-N |
| Molecular Formula | C10H12O2 |
2'-Chloro-4'-nitroacetophenone 98.0+%, TCI America™
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CAS: 67818-41-1 Molecular Formula: C8H6ClNO3 Molecular Weight (g/mol): 199.59 MDL Number: MFCD00017340 InChI Key: BRFBJVQQCATLSZ-UHFFFAOYSA-N PubChem CID: 314302 IUPAC Name: 1-(2-chloro-4-nitrophenyl)ethan-1-one SMILES: CC(=O)C1=CC=C(C=C1Cl)[N+]([O-])=O
| PubChem CID | 314302 |
|---|---|
| CAS | 67818-41-1 |
| Molecular Weight (g/mol) | 199.59 |
| MDL Number | MFCD00017340 |
| SMILES | CC(=O)C1=CC=C(C=C1Cl)[N+]([O-])=O |
| IUPAC Name | 1-(2-chloro-4-nitrophenyl)ethan-1-one |
| InChI Key | BRFBJVQQCATLSZ-UHFFFAOYSA-N |
| Molecular Formula | C8H6ClNO3 |
Diethyl 3,3-Diethoxypropane-1,1-dicarboxylate 96.0+%, TCI America™
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CAS: 21339-47-9 Molecular Formula: C13H24O6 Molecular Weight (g/mol): 276.329 MDL Number: MFCD00671525 InChI Key: VQUXMFKGQFXVBC-UHFFFAOYSA-N Synonym: 3,3-Diethoxypropane-1,1-dicarboxylic Acid Diethyl Ester PubChem CID: 298328 IUPAC Name: diethyl 2-(2,2-diethoxyethyl)propanedioate SMILES: CCOC(CC(C(=O)OCC)C(=O)OCC)OCC
| PubChem CID | 298328 |
|---|---|
| CAS | 21339-47-9 |
| Molecular Weight (g/mol) | 276.329 |
| MDL Number | MFCD00671525 |
| SMILES | CCOC(CC(C(=O)OCC)C(=O)OCC)OCC |
| Synonym | 3,3-Diethoxypropane-1,1-dicarboxylic Acid Diethyl Ester |
| IUPAC Name | diethyl 2-(2,2-diethoxyethyl)propanedioate |
| InChI Key | VQUXMFKGQFXVBC-UHFFFAOYSA-N |
| Molecular Formula | C13H24O6 |
2-Bromo-2'-nitroacetophenone 98.0+%, TCI America™
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CAS: 6851-99-6 Molecular Formula: C8H6BrNO3 Molecular Weight (g/mol): 244.044 MDL Number: MFCD00010294 InChI Key: SGXUUCSRVVSMGK-UHFFFAOYSA-N Synonym: 2-bromo-2'-nitroacetophenone,2'-nitrophenacyl bromide,2-bromo-1-2-nitrophenyl ethanone,2-nitrophenacyl bromide,2-bromo-1-2-nitro-phenyl-ethanone,o-nitrophenacyl bromide,o-nitrophenethyl bromide,2-o-nitrophenyl ethyl bromide,2-bromo-1-2-nitrophenyl ethan-1-one,ethanone, 2-bromo-1-2-nitrophenyl PubChem CID: 244025 IUPAC Name: 2-bromo-1-(2-nitrophenyl)ethanone SMILES: C1=CC=C(C(=C1)C(=O)CBr)[N+](=O)[O-]
| PubChem CID | 244025 |
|---|---|
| CAS | 6851-99-6 |
| Molecular Weight (g/mol) | 244.044 |
| MDL Number | MFCD00010294 |
| SMILES | C1=CC=C(C(=C1)C(=O)CBr)[N+](=O)[O-] |
| Synonym | 2-bromo-2'-nitroacetophenone,2'-nitrophenacyl bromide,2-bromo-1-2-nitrophenyl ethanone,2-nitrophenacyl bromide,2-bromo-1-2-nitro-phenyl-ethanone,o-nitrophenacyl bromide,o-nitrophenethyl bromide,2-o-nitrophenyl ethyl bromide,2-bromo-1-2-nitrophenyl ethan-1-one,ethanone, 2-bromo-1-2-nitrophenyl |
| IUPAC Name | 2-bromo-1-(2-nitrophenyl)ethanone |
| InChI Key | SGXUUCSRVVSMGK-UHFFFAOYSA-N |
| Molecular Formula | C8H6BrNO3 |
Ethyl (4-Methoxybenzoyl)acetate 97.0+%, TCI America™
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CAS: 2881-83-6 Molecular Formula: C12H14O4 Molecular Weight (g/mol): 222.24 MDL Number: MFCD00449636 InChI Key: KRAHENMBSVAAHD-UHFFFAOYSA-N Synonym: p-Anisoylacetic Acid Ethyl Ester, Ethyl p-Anisoylacetate, (4-Methoxybenzoyl)acetic Acid Ethyl Ester, Ethyl 3-(4-Methoxyphenyl)-3-oxopropionate, 3-(4-Methoxyphenyl)-3-oxopropionic Acid Ethyl Ester PubChem CID: 76150 IUPAC Name: ethyl 3-(4-methoxyphenyl)-3-oxopropanoate SMILES: CCOC(=O)CC(=O)C1=CC=C(C=C1)OC
| PubChem CID | 76150 |
|---|---|
| CAS | 2881-83-6 |
| Molecular Weight (g/mol) | 222.24 |
| MDL Number | MFCD00449636 |
| SMILES | CCOC(=O)CC(=O)C1=CC=C(C=C1)OC |
| Synonym | p-Anisoylacetic Acid Ethyl Ester, Ethyl p-Anisoylacetate, (4-Methoxybenzoyl)acetic Acid Ethyl Ester, Ethyl 3-(4-Methoxyphenyl)-3-oxopropionate, 3-(4-Methoxyphenyl)-3-oxopropionic Acid Ethyl Ester |
| IUPAC Name | ethyl 3-(4-methoxyphenyl)-3-oxopropanoate |
| InChI Key | KRAHENMBSVAAHD-UHFFFAOYSA-N |
| Molecular Formula | C12H14O4 |