In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 5th, 2005 | 17 | No |
Popular Name: 1-(2-Chloro-4-nitrophenyl)-3-methylpiperazine hydrochloride 1-(2-Chloro-4-nitrophenyl)-3-met…
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CAS Numbers: 299425-75-5 , 392710-17-7
1-(2-chloro-4-nitrophenyl)-3-methylpiperazine
1-(2-Chloro-4-nitrophenyl)-3-methylpiperazinehydrochloride
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) | 2.58 | 7 | -44.82 | 2 | 5 | 1 | 66 | 256.713 | 2 | ↓ |
Hi High (pH 8-9.5) | 2.58 | 5.75 | -4.72 | 1 | 5 | 0 | 61 | 255.705 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Purity | 95% | Fluorochem |
Warnings | IRRITANT | Matrix Scientific |