| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 31st, 2008 | 12 | Yes |
Popular Name: N*1*,N*1*-Dimethyl-1-phenyl-ethane-1,2-diamine N*1*,N*1*-Dimethyl-1-phenyl-etha…
Find On: PubMed — Wikipedia — Google
CAS Number: 6342-21-8
(2-Amino-1-phenylethyl)dimethylamine
N*N*DIMETHYLPHENYLETHANEDIAMIN
N-(2-Dimethylamino-2-phenylethyl)amine
N1,N1-Dimethyl-1-phenyl-1,2-ethanediamine
None
| 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) | 0.73 | 4.5 | -120.6 | 4 | 2 | 2 | 32 | 166.268 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.73 | 2.49 | -45.25 | 3 | 2 | 1 | 31 | 165.26 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 114 - 116 | Enamine Building Blocks |
| MP | 114...116 | Enamine Building Blocks |
| 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.