In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 25th, 2008 | 22 | No |
Popular Name: 1-[2-Nitro-4-(trifluoromethyl)phenyl]piperidine-2-carboxylic acid 1-[2-Nitro-4-(trifluoromethyl)ph…
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CAS Number: 1219146-99-2
1-[2-Nitro-4-(trifluoromethyl)phenyl]piperidine-2-
1-[2-nitro-4-(trifluoromethyl)phenyl]piperidine-2-carboxylicacid
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) | 1.51 | 8.2 | -50.03 | 0 | 6 | -1 | 89 | 317.243 | 4 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 130-133° | Fluorochem |
Warnings | IRRITANT | Matrix Scientific |