| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 27th, 2004 | 10 | Yes |
Popular Name: 2-Hydroxy-6-methylbenzonitrile 2-Hydroxy-6-methylbenzonitrile
Find On: PubMed — Wikipedia — Google
CAS Numbers: 73289-66-4 , [73289-66-4]
| 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) | 2.03 | 2.58 | -7.45 | 1 | 2 | 0 | 44 | 133.15 | 0 | ↓ |
| Hi High (pH 8-9.5) | 2.03 | 3.35 | -42.94 | 0 | 2 | -1 | 47 | 132.142 | 0 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | 95% | Fluorochem |
| Purity | 95+% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
