| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 31st, 2008 | 11 | Yes |
Popular Name: 3-(4-methylpiperazin-1-yl)propan-1-amine 3-(4-methylpiperazin-1-yl)propan…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 06/03/4572 , 06/03/72 , 216144-65-9 , 3/6/4572 12:00:00 AM , 4572-03-6
1-(3-Aminopropyl)-4-methylpiperazine
1-(3-Aminopropyl)-4-methylpiperazine, 98%
1-Methyl-4-(3'-aminopropyl)piperazine
1-piperazinepropanamine, 4-methyl-
1-Piperazinepropanamine, 4-methyl- (9CI)
3-(4-methyl-1-piperazinyl)propylamine; nsc60215
3-(4-Methyl-piperazin-1-yl)-propylamine
3-(4-Methylpiperazin-1-yl)propan-1-amine hydrochloride
| 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) | -0.69 | 1.02 | -86.62 | 4 | 3 | 2 | 35 | 159.277 | 3 | ↓ |
| Mid Mid (pH 6-8) | -0.69 | 0.91 | -102.9 | 4 | 3 | 2 | 35 | 159.277 | 3 | ↓ |
| Mid Mid (pH 6-8) | -0.69 | -1.36 | -42.48 | 3 | 3 | 1 | 34 | 158.269 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| BP | 113-114/13mm | Matrix Scientific |
| Boiling_Point | 113-114?/13mm | Alfa-Aesar |
| Boiling_Point | 113-114°/13mm | Alfa-Aesar |
| Purity | 98% | Fluorochem |
| Warnings | Corrosive/Air Sensitive | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
| melting_point | Oil | KeyOrganics |
| PUBCHEM_SUBSTANCE_COMMENT | pending | PDSP via PubChem |
| PUBCHEM_PATENT_ID | WO1992014704A1 | IBM Patent Data |
