In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2008 | 14 | Yes |
Popular Name: 1-(4-Bromobenzyl)piperazine 1-(4-Bromobenzyl)piperazine
Find On: PubMed — Wikipedia — Google
CAS Numbers: 510725-48-1 , 91345-62-9 , [510725-48-1] , [91345-62-9]
1-(4-bromobenzyl)piperazine hydrochloride
1-[(4-bromophenyl)methyl]piperazine
1-[(4-Bromophenyl)methyl]piperazine HCl
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) | 1.85 | 4.06 | -41.17 | 2 | 2 | 1 | 20 | 256.167 | 2 | ↓ |
Hi High (pH 8-9.5) | 1.85 | 2.65 | -2.47 | 1 | 2 | 0 | 15 | 255.159 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
BP | 112-116°/0.3mm | Oakwood Chemical |
MP | 56 - 62 | Enamine Building Blocks |
MP | 56-62° | Oakwood Chemical |
MP | 56...62 | Enamine Building Blocks |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
Warnings | IRRITANT | Matrix Scientific |