In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 27th, 2004 | 9 | Yes |
Popular Name: (S)-(+)-5-methyl-1-heptanol (S)-(+)-5-methyl-1-heptanol
Find On: PubMed — Wikipedia — Google
CAS Numbers: 57803-73-3 , 7212-53-5
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) | 2.35 | -0.59 | -2.32 | 1 | 1 | 0 | 20 | 130.231 | 5 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
BP | 84 / 10 | TCI |
PUBCHEM_PATENT_ID | US4935426 | IBM Patent Data |