In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 1st, 2009 | 11 | Yes |
Popular Name: 2-Chloro-3-hydroxybenzoic acid 2-Chloro-3-hydroxybenzoic acid
Find On: PubMed — Wikipedia — Google
CAS Numbers: 51786-10-8 , [51786-10-8]
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) | 1.87 | 2.64 | -48.33 | 1 | 3 | -1 | 60 | 171.559 | 1 | ↓ |
Hi High (pH 8-9.5) | 1.87 | 3.39 | -104.86 | 0 | 3 | -2 | 63 | 170.551 | 1 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
mp | 157 - 158 | MolMall (formerly Molecular Diversity Preservation International) |
Purity | 95% | Fluorochem |