| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 7th, 2004 | 11 | Yes |
Popular Name: 4-Phenyl-2-butanol 4-Phenyl-2-butanol
Find On: PubMed — Wikipedia — Google
CAS Numbers: 22148-86-3 , 2344-70-9 , 39516-03-5
(S)-(+)-4-Phenyl-2-butanol, 97%, ee 99%
(S)-(+)-4-Phenyl-2-butanol, 99+%
| 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) | 2.37 | -0.76 | -3.53 | 1 | 1 | 0 | 20 | 150.221 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| BP | 229° | Oakwood Chemical |
| BP | 239 | TCI |
| Boiling_Point | 239? | Alfa-Aesar |
| Boiling_Point | 239° | Alfa-Aesar |
| Purity | 97% | Fluorochem |
| Purity | 98% | Fluorochem |
| PUBCHEM_PATENT_ID | US5620827 | IBM Patent Data |
| PUBCHEM_PATENT_ID | US5760036; US5776933 | IBM Patent Data |
