In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2005 | 12 | Yes |
Popular Name: 8-Methylnonenoate 8-Methylnonenoate
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CAS Numbers: 21382-25-2 , 59320-77-3 , [59320-77-3]
(CIS)-8-METHYLNON-6-ENOIC ACID
8-methyl-6-nonenoic acid; 8-methylnonenoate; CPD-9329
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) | 2.51 | 2.04 | -45.04 | 0 | 2 | -1 | 40 | 169.244 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.64 | 5.46 | -96.28 | 7 | 9 | 2 | 135 | 453.522 | 6 | ↓ |