Carbonyl compounds
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3-Acetylpyridine 98.0+%, TCI America™
CAS: 350-03-8 Molecular Formula: C7H7NO Molecular Weight (g/mol): 121.139 MDL Number: MFCD00006396 InChI Key: WEGYGNROSJDEIW-UHFFFAOYSA-N Synonym: 3-acetylpyridine,1-pyridin-3-yl ethanone,3-acetopyridine,1-3-pyridinyl ethanone,methyl 3-pyridyl ketone,ethanone, 1-3-pyridinyl,ketone, methyl 3-pyridyl,3-acetyl pyridine,3-pyridyl methyl ketone,1-pyridin-3-yl ethan-1-one PubChem CID: 9589 IUPAC Name: 1-pyridin-3-ylethanone SMILES: CC(=O)C1=CN=CC=C1
| PubChem CID | 9589 |
|---|---|
| CAS | 350-03-8 |
| Molecular Weight (g/mol) | 121.139 |
| MDL Number | MFCD00006396 |
| SMILES | CC(=O)C1=CN=CC=C1 |
| Synonym | 3-acetylpyridine,1-pyridin-3-yl ethanone,3-acetopyridine,1-3-pyridinyl ethanone,methyl 3-pyridyl ketone,ethanone, 1-3-pyridinyl,ketone, methyl 3-pyridyl,3-acetyl pyridine,3-pyridyl methyl ketone,1-pyridin-3-yl ethan-1-one |
| IUPAC Name | 1-pyridin-3-ylethanone |
| InChI Key | WEGYGNROSJDEIW-UHFFFAOYSA-N |
| Molecular Formula | C7H7NO |
2-Acetylthiophene 98.0+%, TCI America™
CAS: 88-15-3 Molecular Formula: C6H6OS Molecular Weight (g/mol): 126.173 MDL Number: MFCD00005442 InChI Key: WYJOVVXUZNRJQY-UHFFFAOYSA-N Synonym: 2-acetylthiophene,1-2-thienyl ethanone,1-thiophen-2-yl-ethanone,methyl 2-thienyl ketone,2-acetothienone,2-acetothiophene,ethanone, 1-2-thienyl,2-acetyl thiophene,ketone, methyl 2-thienyl,2-thienyl methyl ketone PubChem CID: 6920 IUPAC Name: 1-thiophen-2-ylethanone SMILES: CC(=O)C1=CC=CS1
| PubChem CID | 6920 |
|---|---|
| CAS | 88-15-3 |
| Molecular Weight (g/mol) | 126.173 |
| MDL Number | MFCD00005442 |
| SMILES | CC(=O)C1=CC=CS1 |
| Synonym | 2-acetylthiophene,1-2-thienyl ethanone,1-thiophen-2-yl-ethanone,methyl 2-thienyl ketone,2-acetothienone,2-acetothiophene,ethanone, 1-2-thienyl,2-acetyl thiophene,ketone, methyl 2-thienyl,2-thienyl methyl ketone |
| IUPAC Name | 1-thiophen-2-ylethanone |
| InChI Key | WYJOVVXUZNRJQY-UHFFFAOYSA-N |
| Molecular Formula | C6H6OS |
1-Bromo-3,3,3-trifluoroacetone 95.0+%, TCI America™
CAS: 431-35-6 Molecular Formula: C3H2BrF3O Molecular Weight (g/mol): 190.95 MDL Number: MFCD00039237 InChI Key: ONZQYZKCUHFORE-UHFFFAOYSA-N Synonym: 3-bromo-1,1,1-trifluoroacetone,1-bromo-3,3,3-trifluoroacetone,bromotrifluoroacetone,3-bromo-1,1,1-trifluoro-2-propanone,3-bromo-1,1,1-trifluoropropanone,1-bromo-3,3,3-trifluoro-2-propanone,2-propanone, 3-bromo-1,1,1-trifluoro,1,1,1-trifluoro-3-bromopropanone,3-bromo-1,1,1-trifluoro-propan-2-one,bromotrifloroacetone PubChem CID: 79008 IUPAC Name: 3-bromo-1,1,1-trifluoropropan-2-one SMILES: FC(F)(F)C(=O)CBr
| PubChem CID | 79008 |
|---|---|
| CAS | 431-35-6 |
| Molecular Weight (g/mol) | 190.95 |
| MDL Number | MFCD00039237 |
| SMILES | FC(F)(F)C(=O)CBr |
| Synonym | 3-bromo-1,1,1-trifluoroacetone,1-bromo-3,3,3-trifluoroacetone,bromotrifluoroacetone,3-bromo-1,1,1-trifluoro-2-propanone,3-bromo-1,1,1-trifluoropropanone,1-bromo-3,3,3-trifluoro-2-propanone,2-propanone, 3-bromo-1,1,1-trifluoro,1,1,1-trifluoro-3-bromopropanone,3-bromo-1,1,1-trifluoro-propan-2-one,bromotrifloroacetone |
| IUPAC Name | 3-bromo-1,1,1-trifluoropropan-2-one |
| InChI Key | ONZQYZKCUHFORE-UHFFFAOYSA-N |
| Molecular Formula | C3H2BrF3O |
5-Bromo-2-furaldehyde 98.0+%, TCI America™
CAS: 1899-24-7 Molecular Formula: C5H3BrO2 Molecular Weight (g/mol): 174.98 MDL Number: MFCD00159501 InChI Key: WJTFHWXMITZNHS-UHFFFAOYSA-N Synonym: 5-bromo-2-furaldehyde,5-bromofurfural,5-bromo-2-furfural,5-bromofuran-2-carboxaldehyde,5-bromofurancarboxaldehyde,2-furancarboxaldehyde, 5-bromo,5-bromofuraldehyde,5-bromo-furan-2-carbaldehyde,2-furaldehyde, 5-bromo,5-bromo-furfural PubChem CID: 600328 IUPAC Name: 5-bromofuran-2-carbaldehyde SMILES: BrC1=CC=C(O1)C=O
| PubChem CID | 600328 |
|---|---|
| CAS | 1899-24-7 |
| Molecular Weight (g/mol) | 174.98 |
| MDL Number | MFCD00159501 |
| SMILES | BrC1=CC=C(O1)C=O |
| Synonym | 5-bromo-2-furaldehyde,5-bromofurfural,5-bromo-2-furfural,5-bromofuran-2-carboxaldehyde,5-bromofurancarboxaldehyde,2-furancarboxaldehyde, 5-bromo,5-bromofuraldehyde,5-bromo-furan-2-carbaldehyde,2-furaldehyde, 5-bromo,5-bromo-furfural |
| IUPAC Name | 5-bromofuran-2-carbaldehyde |
| InChI Key | WJTFHWXMITZNHS-UHFFFAOYSA-N |
| Molecular Formula | C5H3BrO2 |
Vanillin 98.0+%, TCI America™
CAS: 121-33-5 Molecular Formula: C8H8O3 Molecular Weight (g/mol): 152.15 MDL Number: MFCD00006942,MFCD08702848 InChI Key: MWOOGOJBHIARFG-UHFFFAOYSA-N Synonym: vanillin,vanillaldehyde,vanillic aldehyde,vanilla,p-vanillin,2-methoxy-4-formylphenol,vanilline,lioxin,4-hydroxy-m-anisaldehyde,3-methoxy-4-hydroxybenzaldehyde PubChem CID: 1183 ChEBI: CHEBI:18346 IUPAC Name: 4-hydroxy-3-methoxybenzaldehyde SMILES: COC1=CC(C=O)=CC=C1O
| PubChem CID | 1183 |
|---|---|
| CAS | 121-33-5 |
| Molecular Weight (g/mol) | 152.15 |
| ChEBI | CHEBI:18346 |
| MDL Number | MFCD00006942,MFCD08702848 |
| SMILES | COC1=CC(C=O)=CC=C1O |
| Synonym | vanillin,vanillaldehyde,vanillic aldehyde,vanilla,p-vanillin,2-methoxy-4-formylphenol,vanilline,lioxin,4-hydroxy-m-anisaldehyde,3-methoxy-4-hydroxybenzaldehyde |
| IUPAC Name | 4-hydroxy-3-methoxybenzaldehyde |
| InChI Key | MWOOGOJBHIARFG-UHFFFAOYSA-N |
| Molecular Formula | C8H8O3 |
Heptadecanal 97.0+%, TCI America™
CAS: 629-90-3 Molecular Formula: C17H34O Molecular Weight (g/mol): 254.458 MDL Number: MFCD04034658 InChI Key: PIYDVAYKYBWPPY-UHFFFAOYSA-N Synonym: Heptadecanaldehyde, Heptadecyl Aldehyde PubChem CID: 71552 IUPAC Name: heptadecanal SMILES: CCCCCCCCCCCCCCCCC=O
| PubChem CID | 71552 |
|---|---|
| CAS | 629-90-3 |
| Molecular Weight (g/mol) | 254.458 |
| MDL Number | MFCD04034658 |
| SMILES | CCCCCCCCCCCCCCCCC=O |
| Synonym | Heptadecanaldehyde, Heptadecyl Aldehyde |
| IUPAC Name | heptadecanal |
| InChI Key | PIYDVAYKYBWPPY-UHFFFAOYSA-N |
| Molecular Formula | C17H34O |
4-(1,1-Dioxothiomorpholino)benzaldehyde 98.0+%, TCI America™
CAS: 27913-96-8 Molecular Formula: C11H13NO3S Molecular Weight (g/mol): 239.29 MDL Number: MFCD08276340 InChI Key: JCYZHXMHEACSIN-UHFFFAOYSA-N Synonym: 4-(4-Formylphenyl)thiomorpholine 1,1-Dioxide PubChem CID: 43581615 IUPAC Name: 4-(1,1-dioxo-1λ⁶-thiomorpholin-4-yl)benzaldehyde SMILES: O=CC1=CC=C(C=C1)N1CCS(=O)(=O)CC1
| PubChem CID | 43581615 |
|---|---|
| CAS | 27913-96-8 |
| Molecular Weight (g/mol) | 239.29 |
| MDL Number | MFCD08276340 |
| SMILES | O=CC1=CC=C(C=C1)N1CCS(=O)(=O)CC1 |
| Synonym | 4-(4-Formylphenyl)thiomorpholine 1,1-Dioxide |
| IUPAC Name | 4-(1,1-dioxo-1λ⁶-thiomorpholin-4-yl)benzaldehyde |
| InChI Key | JCYZHXMHEACSIN-UHFFFAOYSA-N |
| Molecular Formula | C11H13NO3S |
4-Methylbenzyl Phenyl Ketone 97.0+%, TCI America™
CAS: 2430-99-1 Molecular Formula: C15H14O Molecular Weight (g/mol): 210.276 InChI Key: WILFDKCJCDVGQX-UHFFFAOYSA-N Synonym: 2-(p-Tolyl)acetophenone, p-Tolylmethyl Phenyl Ketone PubChem CID: 242473 IUPAC Name: 2-(4-methylphenyl)-1-phenylethanone SMILES: CC1=CC=C(C=C1)CC(=O)C2=CC=CC=C2
| PubChem CID | 242473 |
|---|---|
| CAS | 2430-99-1 |
| Molecular Weight (g/mol) | 210.276 |
| SMILES | CC1=CC=C(C=C1)CC(=O)C2=CC=CC=C2 |
| Synonym | 2-(p-Tolyl)acetophenone, p-Tolylmethyl Phenyl Ketone |
| IUPAC Name | 2-(4-methylphenyl)-1-phenylethanone |
| InChI Key | WILFDKCJCDVGQX-UHFFFAOYSA-N |
| Molecular Formula | C15H14O |
Ethyl 3-Oxo-3-(4-pyridyl)propionate 98.0+%, TCI America™
CAS: 26377-17-3 Molecular Formula: C10H11NO3 Molecular Weight (g/mol): 193.20 MDL Number: MFCD00094021 InChI Key: PCJNYGPKMQQCPX-UHFFFAOYSA-N Synonym: ethyl isonicotinoylacetate,ethyl 3-oxo-3-pyridin-4-yl propanoate,ethyl 3-oxo-3-4-pyridyl propionate,ethyl 3-4-pyridyl-3-oxopropionate,3-oxo-3-pyridin-4-yl-propionic acid ethyl ester,ethyl 3-oxo-3-4-pyridinyl propanoate,ethylisonicotinoylacetate,ethyl-4-pyridoyl acetate,ethyl 3-oxo-3-4-pyridyl propanoate,4-pyridinepropanoic acid, b-oxo-, ethyl ester PubChem CID: 2735202 IUPAC Name: ethyl 3-oxo-3-(pyridin-4-yl)propanoate SMILES: CCOC(=O)CC(=O)C1=CC=NC=C1
| PubChem CID | 2735202 |
|---|---|
| CAS | 26377-17-3 |
| Molecular Weight (g/mol) | 193.20 |
| MDL Number | MFCD00094021 |
| SMILES | CCOC(=O)CC(=O)C1=CC=NC=C1 |
| Synonym | ethyl isonicotinoylacetate,ethyl 3-oxo-3-pyridin-4-yl propanoate,ethyl 3-oxo-3-4-pyridyl propionate,ethyl 3-4-pyridyl-3-oxopropionate,3-oxo-3-pyridin-4-yl-propionic acid ethyl ester,ethyl 3-oxo-3-4-pyridinyl propanoate,ethylisonicotinoylacetate,ethyl-4-pyridoyl acetate,ethyl 3-oxo-3-4-pyridyl propanoate,4-pyridinepropanoic acid, b-oxo-, ethyl ester |
| IUPAC Name | ethyl 3-oxo-3-(pyridin-4-yl)propanoate |
| InChI Key | PCJNYGPKMQQCPX-UHFFFAOYSA-N |
| Molecular Formula | C10H11NO3 |
1-Acetoxy-3-chloroacetone 95.0+%, TCI America™
CAS: 40235-68-5 Molecular Formula: C5H7ClO3 Molecular Weight (g/mol): 150.56 MDL Number: MFCD00191365 InChI Key: LCMPIWIWBGHBOY-UHFFFAOYSA-N Synonym: 1-Acetoxy-3-acetenyl Chloride, 1-Acetoxy-3-chloro-2-propanone PubChem CID: 38413 IUPAC Name: 3-chloro-2-oxopropyl acetate SMILES: CC(=O)OCC(=O)CCl
| PubChem CID | 38413 |
|---|---|
| CAS | 40235-68-5 |
| Molecular Weight (g/mol) | 150.56 |
| MDL Number | MFCD00191365 |
| SMILES | CC(=O)OCC(=O)CCl |
| Synonym | 1-Acetoxy-3-acetenyl Chloride, 1-Acetoxy-3-chloro-2-propanone |
| IUPAC Name | 3-chloro-2-oxopropyl acetate |
| InChI Key | LCMPIWIWBGHBOY-UHFFFAOYSA-N |
| Molecular Formula | C5H7ClO3 |
Pivalaldehyde 95.0+%, TCI America™
CAS: 630-19-3 Molecular Formula: C5H10O Molecular Weight (g/mol): 86.13 MDL Number: MFCD00006962 InChI Key: FJJYHTVHBVXEEQ-UHFFFAOYSA-N Synonym: trimethylacetaldehyde,pivalaldehyde,pivaldehyde,propanal, 2,2-dimethyl,neopentanal,pivalic aldehyde,2,2-dimethylpropionaldehyde,unii-ssc20260qw,trimethyl acetaldehyde,trimethylacetaldehyde pivaldehyde PubChem CID: 12417 IUPAC Name: 2,2-dimethylpropanal SMILES: CC(C)(C)C=O
| PubChem CID | 12417 |
|---|---|
| CAS | 630-19-3 |
| Molecular Weight (g/mol) | 86.13 |
| MDL Number | MFCD00006962 |
| SMILES | CC(C)(C)C=O |
| Synonym | trimethylacetaldehyde,pivalaldehyde,pivaldehyde,propanal, 2,2-dimethyl,neopentanal,pivalic aldehyde,2,2-dimethylpropionaldehyde,unii-ssc20260qw,trimethyl acetaldehyde,trimethylacetaldehyde pivaldehyde |
| IUPAC Name | 2,2-dimethylpropanal |
| InChI Key | FJJYHTVHBVXEEQ-UHFFFAOYSA-N |
| Molecular Formula | C5H10O |
4'-Iodoacetophenone 98.0+%, TCI America™
CAS: 13329-40-3 Molecular Formula: C8H7IO Molecular Weight (g/mol): 246.047 MDL Number: MFCD00045320 InChI Key: JZJWCDQGIPQBAO-UHFFFAOYSA-N Synonym: 4'-iodoacetophenone,1-4-iodophenyl ethanone,4-iodoacetophenone,1-4-iodophenyl ethan-1-one,p-iodoacetophenone,ethanone, 1-4-iodophenyl,1-4-iodo-phenyl-ethanone,1-acetyl-4-iodobenzene,4-iodo acetophenone,4;-iodoacetophenone PubChem CID: 72869 IUPAC Name: 1-(4-iodophenyl)ethanone SMILES: CC(=O)C1=CC=C(C=C1)I
| PubChem CID | 72869 |
|---|---|
| CAS | 13329-40-3 |
| Molecular Weight (g/mol) | 246.047 |
| MDL Number | MFCD00045320 |
| SMILES | CC(=O)C1=CC=C(C=C1)I |
| Synonym | 4'-iodoacetophenone,1-4-iodophenyl ethanone,4-iodoacetophenone,1-4-iodophenyl ethan-1-one,p-iodoacetophenone,ethanone, 1-4-iodophenyl,1-4-iodo-phenyl-ethanone,1-acetyl-4-iodobenzene,4-iodo acetophenone,4;-iodoacetophenone |
| IUPAC Name | 1-(4-iodophenyl)ethanone |
| InChI Key | JZJWCDQGIPQBAO-UHFFFAOYSA-N |
| Molecular Formula | C8H7IO |
Benzil 99.0+%, TCI America™
CAS: 134-81-6 Molecular Formula: C14H10O2 Molecular Weight (g/mol): 210.23 MDL Number: MFCD00003080 InChI Key: WURBFLDFSFBTLW-UHFFFAOYSA-N Synonym: benzil,diphenylethanedione,dibenzoyl,diphenylglyoxal,bibenzoyl,ethanedione, diphenyl,1,2-diphenylethanedione,diphenylethane-1,2-dione,glyoxal, diphenyl,diphenyldiketon PubChem CID: 8651 ChEBI: CHEBI:51507 IUPAC Name: diphenylethane-1,2-dione SMILES: O=C(C(=O)C1=CC=CC=C1)C1=CC=CC=C1
| PubChem CID | 8651 |
|---|---|
| CAS | 134-81-6 |
| Molecular Weight (g/mol) | 210.23 |
| ChEBI | CHEBI:51507 |
| MDL Number | MFCD00003080 |
| SMILES | O=C(C(=O)C1=CC=CC=C1)C1=CC=CC=C1 |
| Synonym | benzil,diphenylethanedione,dibenzoyl,diphenylglyoxal,bibenzoyl,ethanedione, diphenyl,1,2-diphenylethanedione,diphenylethane-1,2-dione,glyoxal, diphenyl,diphenyldiketon |
| IUPAC Name | diphenylethane-1,2-dione |
| InChI Key | WURBFLDFSFBTLW-UHFFFAOYSA-N |
| Molecular Formula | C14H10O2 |
Diacetyl 98.0+%, TCI America™
CAS: 431-03-8 Molecular Formula: C4H6O2 Molecular Weight (g/mol): 86.09 MDL Number: MFCD00008756 InChI Key: QSJXEFYPDANLFS-UHFFFAOYSA-N Synonym: 2,3-butanedione,diacetyl,biacetyl,dimethylglyoxal,2,3-diketobutane,dimethyl glyoxal,butanedione,dimethyl diketone,2,3-butadione,2,3-dioxobutane PubChem CID: 650 ChEBI: CHEBI:16583 IUPAC Name: butane-2,3-dione SMILES: CC(=O)C(=O)C
| PubChem CID | 650 |
|---|---|
| CAS | 431-03-8 |
| Molecular Weight (g/mol) | 86.09 |
| ChEBI | CHEBI:16583 |
| MDL Number | MFCD00008756 |
| SMILES | CC(=O)C(=O)C |
| Synonym | 2,3-butanedione,diacetyl,biacetyl,dimethylglyoxal,2,3-diketobutane,dimethyl glyoxal,butanedione,dimethyl diketone,2,3-butadione,2,3-dioxobutane |
| IUPAC Name | butane-2,3-dione |
| InChI Key | QSJXEFYPDANLFS-UHFFFAOYSA-N |
| Molecular Formula | C4H6O2 |
2',4'-Dichloro-5'-fluoroacetophenone 98.0+%, TCI America™
CAS: 704-10-9 Molecular Formula: C8H5Cl2FO Molecular Weight (g/mol): 207.03 MDL Number: MFCD00077499 InChI Key: FAKJFAMIABOKBW-UHFFFAOYSA-N Synonym: 2',4'-dichloro-5'-fluoroacetophenone,1-2,4-dichloro-5-fluorophenyl ethanone,2,4-dichloro-5-fluoroacetophenone,1-2,4-dichloro-5-fluorophenyl ethan-1-one,dcfa,acetophenone, 2',4'-dichloro-5'-fluoro,6-acetyl-1,3-dichloro-4-fluorobenzene,1-2,4-dichloro-5-fluoro-phenyl ethanone,ethanone, 1-2,4-dichloro-5-fluorophenyl,1-acetyl-2,4-dichloro-5-fluorobenzene PubChem CID: 727250 IUPAC Name: 1-(2,4-dichloro-5-fluorophenyl)ethan-1-one SMILES: CC(=O)C1=CC(F)=C(Cl)C=C1Cl
| PubChem CID | 727250 |
|---|---|
| CAS | 704-10-9 |
| Molecular Weight (g/mol) | 207.03 |
| MDL Number | MFCD00077499 |
| SMILES | CC(=O)C1=CC(F)=C(Cl)C=C1Cl |
| Synonym | 2',4'-dichloro-5'-fluoroacetophenone,1-2,4-dichloro-5-fluorophenyl ethanone,2,4-dichloro-5-fluoroacetophenone,1-2,4-dichloro-5-fluorophenyl ethan-1-one,dcfa,acetophenone, 2',4'-dichloro-5'-fluoro,6-acetyl-1,3-dichloro-4-fluorobenzene,1-2,4-dichloro-5-fluoro-phenyl ethanone,ethanone, 1-2,4-dichloro-5-fluorophenyl,1-acetyl-2,4-dichloro-5-fluorobenzene |
| IUPAC Name | 1-(2,4-dichloro-5-fluorophenyl)ethan-1-one |
| InChI Key | FAKJFAMIABOKBW-UHFFFAOYSA-N |
| Molecular Formula | C8H5Cl2FO |