| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 17th, 2008 | 11 | Yes |
Popular Name: 1-(3-Chlorophenyl)propan-1-amine 1-(3-Chlorophenyl)propan-1-amine
Find On: PubMed — Wikipedia — Google
CAS Numbers: , 1075715-57-9 , 1168139-40-9 , 1168139-52-3 , 40023-86-7 , [1168139-52-3] , [40023-86-7]
(R)-1-(3-chloro phenyl)propan-1-amine
(R)-1-(3-CHLOROPHENYL)PROPAN-1-AMINE
(R)-1-(3-Chlorophenyl)propan-1-amine hydrochloride
(R)-1-(3-CHLOROPHENYL)PROPAN-1-AMINE-HCl
(R)-1-(3-Chlorophenyl)propan-1-aminehydrochloride
| 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) | 0.96 | 4.56 | -43.15 | 3 | 1 | 1 | 28 | 170.663 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.72 | 5.04 | -84.95 | 4 | 3 | 2 | 55 | 257.362 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95% | Fluorochem |
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.