| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 16th, 2008 | 14 | Yes |
Popular Name: (1S)-1-(4-isobutoxyphenyl)ethanamine (1S)-1-(4-isobutoxyphenyl)ethana…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1212119-90-8 , 1807938-90-4 , 953894-81-0
(1S)-1-[4-(2-methylpropoxy)phenyl]ethan-1-amine; acetic acid
1-[4-(2-methylpropoxy)phenyl]ethan-1-amine
| 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) | 0.98 | 4.98 | -44.14 | 3 | 2 | 1 | 37 | 194.298 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| MP | 97 - 99 | Enamine Building Blocks |
| MP | 97...99 | Enamine Building Blocks |
