Organooxygen compounds
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Hexafluoroacetone Hydrate 97.0+%, TCI America™
CAS: 34202-69-2 Molecular Formula: C3H6F6O4 Molecular Weight (g/mol): 220.067 MDL Number: MFCD00149061 InChI Key: SNZAEUWCEHDROX-UHFFFAOYSA-N Synonym: hexafluoroacetone trihydrate,1,1,1,3,3,3-hexafluoropropan-2-one trihydrate,2-propanone, hexafluoro-, trihydrate,hfa trihydrate,acetone, hexafluoro-, trihydrate,2-propanone, 1,1,1,3,3,3-hexafluoro-, trihydrate,perfluoroacetone trihydrate,hexafluoro-2-propanone trihydrate,hexafluoro-2-propanone trihydrate; perfluoroacetone trihydrate,hexafluoroacetonetrihydrate PubChem CID: 36719 IUPAC Name: 1,1,1,3,3,3-hexafluoropropan-2-one;trihydrate SMILES: C(=O)(C(F)(F)F)C(F)(F)F.O.O.O
| PubChem CID | 36719 |
|---|---|
| CAS | 34202-69-2 |
| Molecular Weight (g/mol) | 220.067 |
| MDL Number | MFCD00149061 |
| SMILES | C(=O)(C(F)(F)F)C(F)(F)F.O.O.O |
| Synonym | hexafluoroacetone trihydrate,1,1,1,3,3,3-hexafluoropropan-2-one trihydrate,2-propanone, hexafluoro-, trihydrate,hfa trihydrate,acetone, hexafluoro-, trihydrate,2-propanone, 1,1,1,3,3,3-hexafluoro-, trihydrate,perfluoroacetone trihydrate,hexafluoro-2-propanone trihydrate,hexafluoro-2-propanone trihydrate; perfluoroacetone trihydrate,hexafluoroacetonetrihydrate |
| IUPAC Name | 1,1,1,3,3,3-hexafluoropropan-2-one;trihydrate |
| InChI Key | SNZAEUWCEHDROX-UHFFFAOYSA-N |
| Molecular Formula | C3H6F6O4 |
2-Butyl-3-(4-hydroxy-3,5-diiodobenzoyl)benzofuran 98.0+%, TCI America™
CAS: 1951-26-4 Molecular Formula: C19H16I2O3 Molecular Weight (g/mol): 546.143 MDL Number: MFCD02675787 InChI Key: PNFMEGSMKIHDFZ-UHFFFAOYSA-N Synonym: (2-Butyl-3-benzofuranyl)(4-hydroxy-3,5-diiodophenyl)methanone PubChem CID: 74769 ChEBI: CHEBI:79661 IUPAC Name: (2-butyl-1-benzofuran-3-yl)-(4-hydroxy-3,5-diiodophenyl)methanone SMILES: CCCCC1=C(C2=CC=CC=C2O1)C(=O)C3=CC(=C(C(=C3)I)O)I
| PubChem CID | 74769 |
|---|---|
| CAS | 1951-26-4 |
| Molecular Weight (g/mol) | 546.143 |
| ChEBI | CHEBI:79661 |
| MDL Number | MFCD02675787 |
| SMILES | CCCCC1=C(C2=CC=CC=C2O1)C(=O)C3=CC(=C(C(=C3)I)O)I |
| Synonym | (2-Butyl-3-benzofuranyl)(4-hydroxy-3,5-diiodophenyl)methanone |
| IUPAC Name | (2-butyl-1-benzofuran-3-yl)-(4-hydroxy-3,5-diiodophenyl)methanone |
| InChI Key | PNFMEGSMKIHDFZ-UHFFFAOYSA-N |
| Molecular Formula | C19H16I2O3 |
2-(4-Chlorobenzoyl)pyridine 97.0+%, TCI America™
CAS: 6318-51-0 Molecular Formula: C12H8ClNO Molecular Weight (g/mol): 217.65 MDL Number: MFCD02930888 InChI Key: KHXSJSBQIWAIEG-UHFFFAOYSA-N Synonym: 4-Chlorophenyl 2-Pyridyl Ketone PubChem CID: 80594 IUPAC Name: 2-(4-chlorobenzoyl)pyridine SMILES: ClC1=CC=C(C=C1)C(=O)C1=CC=CC=N1
| PubChem CID | 80594 |
|---|---|
| CAS | 6318-51-0 |
| Molecular Weight (g/mol) | 217.65 |
| MDL Number | MFCD02930888 |
| SMILES | ClC1=CC=C(C=C1)C(=O)C1=CC=CC=N1 |
| Synonym | 4-Chlorophenyl 2-Pyridyl Ketone |
| IUPAC Name | 2-(4-chlorobenzoyl)pyridine |
| InChI Key | KHXSJSBQIWAIEG-UHFFFAOYSA-N |
| Molecular Formula | C12H8ClNO |
3'-Chloro-4'-fluoroacetophenone 98.0+%, TCI America™
CAS: 2923-66-2 Molecular Formula: C8H6ClFO Molecular Weight (g/mol): 172.58 MDL Number: MFCD00042203 InChI Key: PCJPESKRPOTNGU-UHFFFAOYSA-N Synonym: 3'-chloro-4'-fluoroacetophenone,3-chloro-4-fluoroacetophenone,1-3-chloro-4-fluorophenyl ethanone,1-3-chloro-4-fluorophenyl ethan-1-one,ethanone, 1-3-chloro-4-fluorophenyl,1-3-chloro-4-fluoro-phenyl-ethanone,1-acetyl-3-chloro-4-fluorobenzene,pubchem4202,ksc699k7b,3-chloro-4-fluoro acetophenone PubChem CID: 520422 IUPAC Name: 1-(3-chloro-4-fluorophenyl)ethan-1-one SMILES: CC(=O)C1=CC=C(F)C(Cl)=C1
| PubChem CID | 520422 |
|---|---|
| CAS | 2923-66-2 |
| Molecular Weight (g/mol) | 172.58 |
| MDL Number | MFCD00042203 |
| SMILES | CC(=O)C1=CC=C(F)C(Cl)=C1 |
| Synonym | 3'-chloro-4'-fluoroacetophenone,3-chloro-4-fluoroacetophenone,1-3-chloro-4-fluorophenyl ethanone,1-3-chloro-4-fluorophenyl ethan-1-one,ethanone, 1-3-chloro-4-fluorophenyl,1-3-chloro-4-fluoro-phenyl-ethanone,1-acetyl-3-chloro-4-fluorobenzene,pubchem4202,ksc699k7b,3-chloro-4-fluoro acetophenone |
| IUPAC Name | 1-(3-chloro-4-fluorophenyl)ethan-1-one |
| InChI Key | PCJPESKRPOTNGU-UHFFFAOYSA-N |
| Molecular Formula | C8H6ClFO |
2'-Amino-4',5'-dimethoxyacetophenone 98.0+%, TCI America™
CAS: 4101-30-8 Molecular Formula: C10H13NO3 Molecular Weight (g/mol): 195.218 MDL Number: MFCD00016646 InChI Key: KGKWXEGYKGTMAK-UHFFFAOYSA-N Synonym: 1-2-amino-4,5-dimethoxyphenyl ethanone,2'-amino-4',5'-dimethoxyacetophenone,2-amino-4,5-dimethoxyacetophenone,1-2-amino-4,5-dimethoxyphenyl ethan-1-one,1-2-amino-4,5-dimethoxyhenyl ethanone,ethanone, 1-2-amino-4,5-dimethoxyphenyl,1-acetyl-2-amino-4,5-dimethoxybenzene,pubchem4007,acmc-1arib,2-acetyl-4,5-dimethoxyaniline PubChem CID: 602085 IUPAC Name: 1-(2-amino-4,5-dimethoxyphenyl)ethanone SMILES: CC(=O)C1=CC(=C(C=C1N)OC)OC
| PubChem CID | 602085 |
|---|---|
| CAS | 4101-30-8 |
| Molecular Weight (g/mol) | 195.218 |
| MDL Number | MFCD00016646 |
| SMILES | CC(=O)C1=CC(=C(C=C1N)OC)OC |
| Synonym | 1-2-amino-4,5-dimethoxyphenyl ethanone,2'-amino-4',5'-dimethoxyacetophenone,2-amino-4,5-dimethoxyacetophenone,1-2-amino-4,5-dimethoxyphenyl ethan-1-one,1-2-amino-4,5-dimethoxyhenyl ethanone,ethanone, 1-2-amino-4,5-dimethoxyphenyl,1-acetyl-2-amino-4,5-dimethoxybenzene,pubchem4007,acmc-1arib,2-acetyl-4,5-dimethoxyaniline |
| IUPAC Name | 1-(2-amino-4,5-dimethoxyphenyl)ethanone |
| InChI Key | KGKWXEGYKGTMAK-UHFFFAOYSA-N |
| Molecular Formula | C10H13NO3 |
2',5'-Dihydroxyacetophenone 98.0+%, TCI America™
CAS: 490-78-8 Molecular Formula: C8H8O3 Molecular Weight (g/mol): 152.149 MDL Number: MFCD00002343 InChI Key: WLDWSGZHNBANIO-UHFFFAOYSA-N Synonym: 2',5'-dihydroxyacetophenone,1-2,5-dihydroxyphenyl ethanone,2-acetylhydroquinone,2,5-dihydroxyacetophenone,quinacetophenone,acetylhydroquinone,ethanone, 1-2,5-dihydroxyphenyl,1-2,5-dihydroxyphenyl ethan-1-one,acetylquinol,acetophenone, 2',5'-dihydroxy PubChem CID: 10279 IUPAC Name: 1-(2,5-dihydroxyphenyl)ethanone SMILES: CC(=O)C1=C(C=CC(=C1)O)O
| PubChem CID | 10279 |
|---|---|
| CAS | 490-78-8 |
| Molecular Weight (g/mol) | 152.149 |
| MDL Number | MFCD00002343 |
| SMILES | CC(=O)C1=C(C=CC(=C1)O)O |
| Synonym | 2',5'-dihydroxyacetophenone,1-2,5-dihydroxyphenyl ethanone,2-acetylhydroquinone,2,5-dihydroxyacetophenone,quinacetophenone,acetylhydroquinone,ethanone, 1-2,5-dihydroxyphenyl,1-2,5-dihydroxyphenyl ethan-1-one,acetylquinol,acetophenone, 2',5'-dihydroxy |
| IUPAC Name | 1-(2,5-dihydroxyphenyl)ethanone |
| InChI Key | WLDWSGZHNBANIO-UHFFFAOYSA-N |
| Molecular Formula | C8H8O3 |
2',6'-Dichloro-3'-fluoroacetophenone 97.0+%, TCI America™
CAS: 290835-85-7 Molecular Formula: C8H5Cl2FO Molecular Weight (g/mol): 207.03 MDL Number: MFCD02093760 InChI Key: VJBFZHHRVCPAPZ-UHFFFAOYSA-N Synonym: 2',6'-dichloro-3'-fluoroacetophenone,1-2,6-dichloro-3-fluorophenyl ethanone,2,6-dichloro-3-fluoroacetophenone,1-2,6-dichloro-3-fluorophenyl ethan-1-one,2,6-dichloro-3-fluro acetophenone,2,6-dichloro-5-fluoro acetophenone,2',6'-dichloro-3'-fluroacetophenone,ethanone, 1-2,6-dichloro-3-fluorophenyl,1-acetyl-2,6-dichloro-3-fluorobenzene,pubchem8532 PubChem CID: 2733982 IUPAC Name: 1-(2,6-dichloro-3-fluorophenyl)ethan-1-one SMILES: CC(=O)C1=C(Cl)C=CC(F)=C1Cl
| PubChem CID | 2733982 |
|---|---|
| CAS | 290835-85-7 |
| Molecular Weight (g/mol) | 207.03 |
| MDL Number | MFCD02093760 |
| SMILES | CC(=O)C1=C(Cl)C=CC(F)=C1Cl |
| Synonym | 2',6'-dichloro-3'-fluoroacetophenone,1-2,6-dichloro-3-fluorophenyl ethanone,2,6-dichloro-3-fluoroacetophenone,1-2,6-dichloro-3-fluorophenyl ethan-1-one,2,6-dichloro-3-fluro acetophenone,2,6-dichloro-5-fluoro acetophenone,2',6'-dichloro-3'-fluroacetophenone,ethanone, 1-2,6-dichloro-3-fluorophenyl,1-acetyl-2,6-dichloro-3-fluorobenzene,pubchem8532 |
| IUPAC Name | 1-(2,6-dichloro-3-fluorophenyl)ethan-1-one |
| InChI Key | VJBFZHHRVCPAPZ-UHFFFAOYSA-N |
| Molecular Formula | C8H5Cl2FO |
Furil 98.0+%, TCI America™
CAS: 492-94-4 Molecular Formula: C10H6O4 Molecular Weight (g/mol): 190.154 MDL Number: MFCD00003241 InChI Key: SXPUVBFQXJHYNS-UHFFFAOYSA-N Synonym: furil,alpha-furil,bipyromucyl,2,2'-furil,bipryomucyl,di-2-furylglyoxal,difuranylglyoxal,ethanedione, di-2-furanyl,di-2-furanylethanedione,a-furil PubChem CID: 68119 IUPAC Name: 1,2-bis(furan-2-yl)ethane-1,2-dione SMILES: C1=COC(=C1)C(=O)C(=O)C2=CC=CO2
| PubChem CID | 68119 |
|---|---|
| CAS | 492-94-4 |
| Molecular Weight (g/mol) | 190.154 |
| MDL Number | MFCD00003241 |
| SMILES | C1=COC(=C1)C(=O)C(=O)C2=CC=CO2 |
| Synonym | furil,alpha-furil,bipyromucyl,2,2'-furil,bipryomucyl,di-2-furylglyoxal,difuranylglyoxal,ethanedione, di-2-furanyl,di-2-furanylethanedione,a-furil |
| IUPAC Name | 1,2-bis(furan-2-yl)ethane-1,2-dione |
| InChI Key | SXPUVBFQXJHYNS-UHFFFAOYSA-N |
| Molecular Formula | C10H6O4 |
Emodin 96.0+%, TCI America™
CAS: 518-82-1 Molecular Formula: C15H10O5 Molecular Weight (g/mol): 270.24 MDL Number: MFCD00001207 InChI Key: RHMXXJGYXNZAPX-UHFFFAOYSA-N Synonym: emodin,schuttgelb,emodol,frangula emodin,rheum emodin,frangulic acid,3-methyl-1,6,8-trihydroxyanthraquinone,archin,persian berry lake,1,3,8-trihydroxy-6-methyl-9,10-anthraquinone PubChem CID: 3220 ChEBI: CHEBI:42223 IUPAC Name: 1,3,8-trihydroxy-6-methylanthracene-9,10-dione SMILES: CC1=CC(=C2C(=C1)C(=O)C3=CC(=CC(=C3C2=O)O)O)O
| PubChem CID | 3220 |
|---|---|
| CAS | 518-82-1 |
| Molecular Weight (g/mol) | 270.24 |
| ChEBI | CHEBI:42223 |
| MDL Number | MFCD00001207 |
| SMILES | CC1=CC(=C2C(=C1)C(=O)C3=CC(=CC(=C3C2=O)O)O)O |
| Synonym | emodin,schuttgelb,emodol,frangula emodin,rheum emodin,frangulic acid,3-methyl-1,6,8-trihydroxyanthraquinone,archin,persian berry lake,1,3,8-trihydroxy-6-methyl-9,10-anthraquinone |
| IUPAC Name | 1,3,8-trihydroxy-6-methylanthracene-9,10-dione |
| InChI Key | RHMXXJGYXNZAPX-UHFFFAOYSA-N |
| Molecular Formula | C15H10O5 |
2,2,2-Trifluoro-3'-nitroacetophenone 98.0+%, TCI America™
CAS: 657-15-8 Molecular Formula: C8H4F3NO3 Molecular Weight (g/mol): 219.119 MDL Number: MFCD00034541 InChI Key: QADCNGZPRUSTJL-UHFFFAOYSA-N PubChem CID: 69566 IUPAC Name: 2,2,2-trifluoro-1-(3-nitrophenyl)ethanone SMILES: C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)C(F)(F)F
| PubChem CID | 69566 |
|---|---|
| CAS | 657-15-8 |
| Molecular Weight (g/mol) | 219.119 |
| MDL Number | MFCD00034541 |
| SMILES | C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)C(F)(F)F |
| IUPAC Name | 2,2,2-trifluoro-1-(3-nitrophenyl)ethanone |
| InChI Key | QADCNGZPRUSTJL-UHFFFAOYSA-N |
| Molecular Formula | C8H4F3NO3 |
4,4,4-Trifluoro-1-(p-tolyl)-1,3-butanedione 98.0+%, TCI America™
CAS: 720-94-5 Molecular Formula: C11H9F3O2 Molecular Weight (g/mol): 230.186 MDL Number: MFCD00517909 InChI Key: WRZMHTIRFOFFPY-UHFFFAOYSA-N Synonym: 4,4,4-trifluoro-1-p-tolyl butane-1,3-dione,4,4,4-trifluoro-1-4-methylphenyl butane-1,3-dione,1-4-methylphenyl-4,4,4-trifluorobutane-1,3-dione,l-4-methylphenyl-4,4,4-trifluorobutane-1,3-dione,4,4,4-trifluoro-1-4-methyl phenyl-butane-1,3-dione,3-4-methylbenzoyl-1,1,1-trifluoroacetone,4,4,4-trifluoro-1-p-tolylbutane-1,3-dione,4,4,4-trifluoro-1-p-tolyl-butane-1,3-dione,1-4-methylphenyl-4,4,4-triflurobutane-1,3-dione,1,3-butanedione, 4,4,4-trifluoro-1-4-methylphenyl PubChem CID: 550193 IUPAC Name: 4,4,4-trifluoro-1-(4-methylphenyl)butane-1,3-dione SMILES: CC1=CC=C(C=C1)C(=O)CC(=O)C(F)(F)F
| PubChem CID | 550193 |
|---|---|
| CAS | 720-94-5 |
| Molecular Weight (g/mol) | 230.186 |
| MDL Number | MFCD00517909 |
| SMILES | CC1=CC=C(C=C1)C(=O)CC(=O)C(F)(F)F |
| Synonym | 4,4,4-trifluoro-1-p-tolyl butane-1,3-dione,4,4,4-trifluoro-1-4-methylphenyl butane-1,3-dione,1-4-methylphenyl-4,4,4-trifluorobutane-1,3-dione,l-4-methylphenyl-4,4,4-trifluorobutane-1,3-dione,4,4,4-trifluoro-1-4-methyl phenyl-butane-1,3-dione,3-4-methylbenzoyl-1,1,1-trifluoroacetone,4,4,4-trifluoro-1-p-tolylbutane-1,3-dione,4,4,4-trifluoro-1-p-tolyl-butane-1,3-dione,1-4-methylphenyl-4,4,4-triflurobutane-1,3-dione,1,3-butanedione, 4,4,4-trifluoro-1-4-methylphenyl |
| IUPAC Name | 4,4,4-trifluoro-1-(4-methylphenyl)butane-1,3-dione |
| InChI Key | WRZMHTIRFOFFPY-UHFFFAOYSA-N |
| Molecular Formula | C11H9F3O2 |
Ethyl (2-Methoxybenzoyl)acetate 98.0+%, TCI America™
CAS: 41607-95-8 Molecular Formula: C12H14O4 Molecular Weight (g/mol): 222.24 MDL Number: MFCD01311633 InChI Key: KROPYAVVJDXRPH-UHFFFAOYSA-N Synonym: (2-Methoxybenzoyl)acetic Acid Ethyl Ester, Ethyl 3-(2-Methoxyphenyl)-3-oxopropionate, 3-(2-Methoxyphenyl)-3-oxopropionic Acid Ethyl Ester PubChem CID: 2759695 IUPAC Name: ethyl 3-(2-methoxyphenyl)-3-oxopropanoate SMILES: CCOC(=O)CC(=O)C1=CC=CC=C1OC
| PubChem CID | 2759695 |
|---|---|
| CAS | 41607-95-8 |
| Molecular Weight (g/mol) | 222.24 |
| MDL Number | MFCD01311633 |
| SMILES | CCOC(=O)CC(=O)C1=CC=CC=C1OC |
| Synonym | (2-Methoxybenzoyl)acetic Acid Ethyl Ester, Ethyl 3-(2-Methoxyphenyl)-3-oxopropionate, 3-(2-Methoxyphenyl)-3-oxopropionic Acid Ethyl Ester |
| IUPAC Name | ethyl 3-(2-methoxyphenyl)-3-oxopropanoate |
| InChI Key | KROPYAVVJDXRPH-UHFFFAOYSA-N |
| Molecular Formula | C12H14O4 |
Cyclohexyl Phenyl Ketone 98.0+%, TCI America™
CAS: 712-50-5 Molecular Formula: C13H16O Molecular Weight (g/mol): 188.27 MDL Number: MFCD00001467 InChI Key: BMFYCFSWWDXEPB-UHFFFAOYSA-N Synonym: cyclohexyl phenyl ketone,cyclohexyl phenyl methanone,benzoylcyclohexane,cyclohexylphenylketone,benzoyl cyclohexane,phenyl cyclohexyl ketone,methanone, cyclohexylphenyl,cyclohexyl-phenyl-methanone,usaf kf-3,cyclohexylphenyl ketone PubChem CID: 12837 IUPAC Name: cyclohexyl(phenyl)methanone SMILES: C1CCC(CC1)C(=O)C2=CC=CC=C2
| PubChem CID | 12837 |
|---|---|
| CAS | 712-50-5 |
| Molecular Weight (g/mol) | 188.27 |
| MDL Number | MFCD00001467 |
| SMILES | C1CCC(CC1)C(=O)C2=CC=CC=C2 |
| Synonym | cyclohexyl phenyl ketone,cyclohexyl phenyl methanone,benzoylcyclohexane,cyclohexylphenylketone,benzoyl cyclohexane,phenyl cyclohexyl ketone,methanone, cyclohexylphenyl,cyclohexyl-phenyl-methanone,usaf kf-3,cyclohexylphenyl ketone |
| IUPAC Name | cyclohexyl(phenyl)methanone |
| InChI Key | BMFYCFSWWDXEPB-UHFFFAOYSA-N |
| Molecular Formula | C13H16O |
4,4,4-Trifluoro-1-phenyl-1,3-butanedione 98.0+%, TCI America™
CAS: 326-06-7 Molecular Formula: C10H7F3O2 Molecular Weight (g/mol): 216.16 MDL Number: MFCD00000425 InChI Key: VVXLFFIFNVKFBD-UHFFFAOYSA-N Synonym: benzoyl-1,1,1-trifluoroacetone,benzoyltrifluoroacetone,4,4,4-trifluoro-1-phenyl-1,3-butanedione,benzoyl trifluoroacetyl methane,3-benzoyl-1,1,1-trifluoroacetone,1,3-butanedione, 4,4,4-trifluoro-1-phenyl,4,4,4-trifluoro-1-phenyl-butane-1,3-dione,1-benzoyl-3,3,3-trifluoroacetone,.omega.-trifluoroacetyl acetophenone,1-benzoyl-3,3,3-trifluoro-2-propanone PubChem CID: 67589 IUPAC Name: 4,4,4-trifluoro-1-phenylbutane-1,3-dione SMILES: FC(F)(F)C(=O)CC(=O)C1=CC=CC=C1
| PubChem CID | 67589 |
|---|---|
| CAS | 326-06-7 |
| Molecular Weight (g/mol) | 216.16 |
| MDL Number | MFCD00000425 |
| SMILES | FC(F)(F)C(=O)CC(=O)C1=CC=CC=C1 |
| Synonym | benzoyl-1,1,1-trifluoroacetone,benzoyltrifluoroacetone,4,4,4-trifluoro-1-phenyl-1,3-butanedione,benzoyl trifluoroacetyl methane,3-benzoyl-1,1,1-trifluoroacetone,1,3-butanedione, 4,4,4-trifluoro-1-phenyl,4,4,4-trifluoro-1-phenyl-butane-1,3-dione,1-benzoyl-3,3,3-trifluoroacetone,.omega.-trifluoroacetyl acetophenone,1-benzoyl-3,3,3-trifluoro-2-propanone |
| IUPAC Name | 4,4,4-trifluoro-1-phenylbutane-1,3-dione |
| InChI Key | VVXLFFIFNVKFBD-UHFFFAOYSA-N |
| Molecular Formula | C10H7F3O2 |
4'-Cyanoacetophenone 97.0+%, TCI America™
CAS: 1443-80-7 Molecular Formula: C9H7NO Molecular Weight (g/mol): 145.161 MDL Number: MFCD00001825 InChI Key: NLPHXWGWBKZSJC-UHFFFAOYSA-N Synonym: 4'-cyanoacetophenone,benzonitrile, 4-acetyl,p-cyanoacetophenone,4-cyanoacetophenone,p-acetylbenzonitrile,4-acetyl-benzonitrile,benzonitrile, p-acetyl,4-acetylbenzenecarbonitrile,4-acetylbenznitrile PubChem CID: 74044 IUPAC Name: 4-acetylbenzonitrile SMILES: CC(=O)C1=CC=C(C=C1)C#N
| PubChem CID | 74044 |
|---|---|
| CAS | 1443-80-7 |
| Molecular Weight (g/mol) | 145.161 |
| MDL Number | MFCD00001825 |
| SMILES | CC(=O)C1=CC=C(C=C1)C#N |
| Synonym | 4'-cyanoacetophenone,benzonitrile, 4-acetyl,p-cyanoacetophenone,4-cyanoacetophenone,p-acetylbenzonitrile,4-acetyl-benzonitrile,benzonitrile, p-acetyl,4-acetylbenzenecarbonitrile,4-acetylbenznitrile |
| IUPAC Name | 4-acetylbenzonitrile |
| InChI Key | NLPHXWGWBKZSJC-UHFFFAOYSA-N |
| Molecular Formula | C9H7NO |