| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 7th, 2005 | 9 | No |
Popular Name: 4-Acetylbutyric acid 4-Acetylbutyric acid
Find On: PubMed — Wikipedia — Google
CAS Numbers: 01/06/3128 , 123-76-2 , 3128-06-1 , 6/1/3128 12:00:00 AM , [3128-06-1]
| 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) | 0.15 | 3.35 | -52.55 | 0 | 3 | -1 | 57 | 129.135 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Melting_Point | 12-14? | Alfa-Aesar |
| Melting_Point | 12-14° | Alfa-Aesar |
| MP | 13-14° | Oakwood Chemical |
| BP | 160 / 14 | TCI |
| Boiling_Point | 274-275? | Alfa-Aesar |
| Boiling_Point | 274-275° | Alfa-Aesar |
| Purity | 95% | Fluorochem |
