In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 11th, 2008 | 18 | No |
Popular Name: 2-nitro-5-piperidinobenzenecarboxylic acid 2-nitro-5-piperidinobenzenecarbo…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 118159-39-0 , [118159-39-0]
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) | 2.93 | 6.39 | -60.47 | 0 | 6 | -1 | 89 | 249.246 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
melting_point | 162 - 163 | KeyOrganics |
MP | 162-163° | Matrix Scientific |
Purity | >95% | Matrix Scientific |
Warnings | IRRITANT | Matrix Scientific |