Merck 114-3 Racemate structure
|
Common Name | Merck 114-3 Racemate | ||
|---|---|---|---|---|
| CAS Number | 884599-65-9 | Molecular Weight | 515.53100 | |
| Density | N/A | Boiling Point | N/A | |
| Molecular Formula | C27H31F6NO2 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | N/A | |
| Name | Merck 114-3 Racemate |
|---|---|
| Synonym | More Synonyms |
| Molecular Formula | C27H31F6NO2 |
|---|---|
| Molecular Weight | 515.53100 |
| Exact Mass | 515.22600 |
| PSA | 40.54000 |
| LogP | 8.06740 |
| InChIKey | JWENOJGRPMPNAG-QFWMQHCXSA-N |
| SMILES | CC(C)CCC(c1ccc(C(F)(F)F)cc1)N1CCC(CC(=O)O)CC1c1ccc(C(F)(F)F)cc1 |
| 4-Piperidineacetic acid,1-[(1R)-4-Methyl-1-[4-(trifluoroMethyl)phenyl]pentyl]-2-[4-(trifluoroMethyl)phenyl]-,(2S,4R)-rel |