| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 31st, 2008 | 11 | No |
Popular Name: 1-(3-chloropropyl)-4-methylpiperazine 1-(3-chloropropyl)-4-methylpiper…
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CAS Numbers: 104-16-5 , 2031-23-4 , [104-16-5] , [2031-23-4]
1- -4-methylpiperazinedihydrochloride
1-(3-chloro-propyl)-4-methyl-piperazine
1-(3-Chloro-propyl)-4-methyl-piperazine dihydrochloride
1-(3-Chloro-propyl)-4-methyl-piperazine; hydrochloride
1-(3-CHLOROPROPYL)-4-METHYL PIPERAZINE DIHYDROCHLO
1-(3-CHLOROPROPYL)-4-METHYL PIPERAZINE DIHYDROCHLORIDE
1-(3-Chloropropyl)-4-methylpiperazine DiHCl
| 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) | 1.11 | 4.23 | -34.39 | 1 | 2 | 1 | 8 | 177.699 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.11 | 4.15 | -36.41 | 1 | 2 | 1 | 8 | 177.699 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.11 | 1.76 | -2.41 | 0 | 2 | 0 | 6 | 176.691 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 23--22° | Oakwood Chemical |
| BP | 243° | Matrix Scientific |
| MP | 252 - 254 | Enamine Building Blocks |
| MP | 252...254 | Enamine Building Blocks |
| BP | 85-87°/7mm | Oakwood Chemical |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95% | Fluorochem |
| Purity | 95+% | Matrix Scientific |
| Purity | 97% | Fluorochem |
| Warnings | IRRITANT | Matrix Scientific |
