In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 7th, 2004 | 13 | Yes |
Popular Name: (1R,2s)-(-)-trans-2-phenyl-1-cyclohexanol (1R,2s)-(-)-trans-2-phenyl-1-cyc…
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CAS Numbers: 1444-64-0 , 2362-61-0 , 34281-92-0 , 98919-68-7 , [98919-68-7]
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 3.15 | -1.17 | -3.65 | 1 | 1 | 0 | 20 | 176.259 | 1 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
BP | 105 / 3 | TCI |
mp | 55 - 56 | MolMall (formerly Molecular Diversity Preservation International) |
MP | 65 | TCI |
Purity | 96% | Fluorochem |