(4-acetyl-3-methylphenyl) trifluoromethanesulfonate structure
|
Common Name | (4-acetyl-3-methylphenyl) trifluoromethanesulfonate | ||
|---|---|---|---|---|
| CAS Number | 252561-46-9 | Molecular Weight | 282.23600 | |
| Density | N/A | Boiling Point | N/A | |
| Molecular Formula | C10H9F3O4S | Melting Point | N/A | |
| MSDS | N/A | Flash Point | N/A | |
| Name | (4-acetyl-3-methylphenyl) trifluoromethanesulfonate |
|---|---|
| Synonym | More Synonyms |
| Molecular Formula | C10H9F3O4S |
|---|---|
| Molecular Weight | 282.23600 |
| Exact Mass | 282.01700 |
| PSA | 68.82000 |
| LogP | 3.50680 |
| InChIKey | MUWRTYJKLDGPJT-UHFFFAOYSA-N |
| SMILES | CC(=O)c1ccc(OS(=O)(=O)C(F)(F)F)cc1C |
|
~94%
(4-acetyl-3-met... CAS#:252561-46-9 |
| Literature: ELI LILLY AND COMPANY Patent: WO2005/118542 A1, 2005 ; Location in patent: Page/Page column 40-41 ; WO 2005/118542 A1 |
|
~18%
(4-acetyl-3-met... CAS#:252561-46-9 |
| Literature: Yoshikai, Naohiko; Matsumoto, Arimasa; Norinder, Jakob; Nakamura, Eiichi Angewandte Chemie, International Edition, 2009 , vol. 48, # 16 p. 2925 - 2928 |
| Precursor 3 | |
|---|---|
| DownStream 0 | |
| trifluoro-methanesulfonic acid 4-acetyl-3-methyl-phenyl ester |
| Methanesulfonic acid,trifluoro-,4-acetyl-3-methylphenyl ester |
| 4-acetyl-3-methylphenyl trifluoromethanesulfonate |
| 3-methyl-4-acetylphenyl triflate |