In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 6th, 2004 | 11 | Yes |
(+)-trans-Carveol; (4S,6R)-trans-Carveol; C11409
(+)-trans-carveol; (4S,6R)-trans-carveol; CPD-260
(-)-Carveol [99-48-9]; (4-Menth-6,8-dien-2-ol)
(-)-Carveol, mixture of isomers
(-)-Carveol, mixture of isomers, 97%
5-Isopropenyl-2-methyl-2-cyclohexen-1-ol; carveols; p-Mentha-1,8-dien-6-ol; p-Mentha-6,8-dien-2-ol
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) | 2.70 | 3.76 | -2.62 | 1 | 1 | 0 | 20 | 152.237 | 1 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Boiling_Point | 227? | Alfa-Aesar |
Boiling_Point | 227° | Alfa-Aesar |
UniProt Database Links | CP2C9_HUMAN; CP2CJ_HUMAN | ChEBI |
UniProt Database Links | CP2C9_HUMAN; CP2CJ_HUMAN; DBR_TOBAC; LIHY_GEOSE; LIMC_RHOER | ChEBI |
Patent Database Links | US2002049346; US2007184133 | ChEBI |
PUBCHEM_PATENT_ID | US6043370 | IBM Patent Data |