| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 7th, 2004 | 10 | Yes |
Popular Name: 3,3,5-Trimethylcyclohexanol 3,3,5-Trimethylcyclohexanol
Find On: PubMed — Wikipedia — Google
CAS Numbers: 116-02-9 , 54352-41-9 , 767-54-4 , 933-48-2 , [116-02-9]
(1S,5S)-3,3,5-trimethylcyclohexan-1-ol
3,3,5-trimethyl-1-cyclohexanol; dihydroisophorol; homomenthol
3,3,5-Trimethylcyclohexanol (cis- and trans- mixture)
Cis-3,3,5-trimethyl cyclohexanol
Cis-3,3,5-trimethylcyclohexanol
cis-3,3,5-Trimethylcyclohexanol (contains ca. 20% trans- isomer)
cis-3,3,5-Trimethylcyclohexanol (contains ca. 6 % trans- isomer)
| 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) | 2.25 | -0.7 | -2.07 | 1 | 1 | 0 | 20 | 142.242 | 0 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 34 | TCI |
| MP | 56 - 58 | Enamine Building Blocks |
| MP | 56...58 | Enamine Building Blocks |
| BP | 86 / 10 | TCI |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95% | Fluorochem |
