| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 8th, 2004 | 12 | Yes |
Popular Name: 4-Phenoxybutan-1-amine 4-Phenoxybutan-1-amine
Find On: PubMed — Wikipedia — Google
CAS Numbers: 16728-66-8 , 64037-61-2 , [16728-66-8]
(4-aminobutoxy)benzene hydrochloride
4-Phenoxy-N-butylamine hydrochloride; Butylamine, 4-phenoxy-, hydrochloride; LS-47437; USAF EL-12
| 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) | 1.34 | 3.68 | -44.89 | 3 | 2 | 1 | 37 | 166.244 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 162 - 164 | Enamine Building Blocks |
| MP | 162...164 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| PUBCHEM_PATENT_ID | WO1995034540A1 | IBM Patent Data |
