| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 5th, 2009 | 12 | Yes |
Popular Name: 4-cyano-2-methylbenzoic acid 4-cyano-2-methylbenzoic acid
Find On: PubMed — Wikipedia — Google
CAS Number: 1975-53-7
| 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) | 1.64 | 6.09 | -43.21 | 0 | 3 | -1 | 64 | 160.152 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 192 - 194 | Enamine Building Blocks |
| MP | 192...194 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95% | Fluorochem |
