In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 11th, 2004 | 9 | Yes |
Popular Name: Beta-methyllevulinic acid Beta-methyllevulinic acid
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CAS Numbers: 152419-49-3 , 6628-79-1
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) | 0.12 | 3.05 | -46.52 | 0 | 3 | -1 | 57 | 129.135 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
BP | 242 | TCI |
MP | 32 | TCI |