In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 27th, 2004 | 10 | Yes |
Popular Name: 6-METHYLHEPTANOIC ACID 6-METHYLHEPTANOIC ACID
Find On: PubMed — Wikipedia — Google
CAS Numbers: 64504-12-7 , 929-10-2 , [929-10-2]
6-METHYLHEPTANOIC ACID; [929-10-2]
Cecanoic C8 acid; Cekanoic C8 acid; EINECS 246-617-0; Isooctanoic acid; LS-85173
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) | 2.49 | 1.6 | -45.04 | 0 | 2 | -1 | 40 | 143.206 | 5 | ↓ |