| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 7th, 2005 | 19 | Yes |
Popular Name: 3-amino-3-[4-(benzyloxy)phenyl]-1-propanol 3-amino-3-[4-(benzyloxy)phenyl]-…
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CAS Numbers: 1213312-93-6 , 182057-85-8 , [182057-85-8]
(S)-3-(4-benzyloxyphenyl)-beta-alaninol
(S)-beta-(4-Benzyloxyphenyl)alaninol
3-(4-BENZYLOXYPHENYL)-DL-β-ALANINOL
3-Amino-3-(4-(benzyloxy)phenyl)propan-1-ol
3-Amino-3-(4-benzyloxy-phenyl)-propan-1-ol
| 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) | 0.72 | -3.76 | -49.85 | 4 | 3 | 1 | 57 | 258.341 | 6 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 106 - 108 | KeyOrganics |
| MP | 106-108° | Matrix Scientific |
| Purity | >95% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
