| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 1st, 2009 | 15 | Yes |
Popular Name: MFCD08667747 MFCD08667747
Find On: PubMed — Wikipedia — Google
CAS Number: 919013-72-2
1-(4-Chloro-phenyl)-N*1*,N*1*-diethyl-ethane-1,2-diamine
1-(4-chlorophenyl)-N1,N1-diethylethane-1,2-diamine
| 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) | 2.16 | 5.83 | -126.65 | 4 | 2 | 2 | 32 | 228.767 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.16 | 5.47 | -32.13 | 3 | 2 | 1 | 30 | 227.759 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.16 | 3.78 | -45.88 | 3 | 2 | 1 | 31 | 227.759 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
