Cyclohexanol, 5-methyl-2-(1-methylethyl)-, 1-benzoate, (1R,2S,5R)-rel-
[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] benzoate
Also Known As: MENTHYL BENZOATE|Racemic menthyl benzoate|dl-menthyl benzoate|Benzoic acid menthyl|Fulvestrant Impurity 15|(-)-Menthyl benzoate|Spectrum_000279|SpecPlus_000853|Spectrum2_001150|Spectrum3_000668|Spectrum4_001889|Spectrum5_000518|Emtricitabine Impurity 31|Emtricitabine Impurity 32|BSPBio_002335|KBioGR_002422|KBioSS_000759|DivK1c_006949|SPECTRUM1800005|SPBio_001079|KBio1_001893|KBio2_000759|KBio2_003327|KBio2_005895|KBio3_001555|KST-1A7328|SDCCGMLS-0066891.P001|NCGC00178701-01|(1r,2s,5r)-rel-2-isopropyl-5-methylcyclohexyl benzoate|5-Methyl-2-(propan-2-yl)cyclohexyl benzoate|Benzoic acid (1R,3R,4S)-p-menthan-3-yl ester
| Molecular Formula | C17H24O2 |
|---|---|
| Molecular Weight | 260.17764 g/mol |
| LogP | 5.3 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 260.17764 |
| Monoisotopic Mass | 260.17764 |
| Heavy Atoms | 19 |
| Complexity | 292.0 |
Chemical Identifiers
| CAS Number | 612-33-9 |
|---|---|
| SMILES | C[C@@H]1CC[C@H]([C@@H](C1)OC(=O)C2=CC=CC=C2)C(C)C |
| InChIKey | TTYVYRHNIVBWCB-VNQPRFMTSA-N |
Product Overview
Cyclohexanol, 5-methyl-2-(1-methylethyl)-, 1-benzoate, (1R,2S,5R)-rel- (CAS 612-33-9), with molecular formula C17H24O2 and molecular weight 260.17764 g/mol. IUPAC: [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] benzoate.