| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 11th, 2004 | 13 | Yes |
Popular Name: 4-butylbenzoic acid 4-butylbenzoic acid
Find On: PubMed — Wikipedia — Google
CAS Numbers: 20651-71-2 , 25651-71-2 , [20651-71-2]
| 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) | 3.71 | 1.5 | -50.72 | 0 | 2 | -1 | 40 | 177.223 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Melting_Point | 100-113? | Alfa-Aesar |
| Melting_Point | 100-113° | Alfa-Aesar |
| Purity | 95% | Fluorochem |
| Purity | 97% | Fluorochem |
| Purity | 99.0% | APIChem |
