Cas no 109527-45-9 (Cyclohexanol,2-(1-methyl-1-phenylethyl)-, (1S,2R)-)
109527-45-9 structure
Product Name:Cyclohexanol,2-(1-methyl-1-phenylethyl)-, (1S,2R)-
CAS No:109527-45-9
MF:C15H22O
MW:218.334584712982
CID:128461
PubChem ID:10976936
Update Time:2025-04-18
Cyclohexanol,2-(1-methyl-1-phenylethyl)-, (1S,2R)- Chemical and Physical Properties
Names and Identifiers
-
- Cyclohexanol,2-(1-methyl-1-phenylethyl)-, (1S,2R)-
- (1S,2R)-(+)-trans-2-(1-Methyl-1-phenylethyl)cyclohexanol
- (+)-(1S,2R)-trans-2-cumyl-cyclohexanol
- (1S,2R)-(+)-2-(1-methyl-1-phenylethyl)cyclohexanol
- (1S,2R)-2-(1-methyl-1-phenylethyl)cyclohexanol
- (1S,2R)-2-(2-phenylpropan-2-yl)cyclohexanol
- 453404_ALDRICH
- I14-45330
- SureCN3276227
- trans-2-cumylcyclohexanol
- (1S,2R)-(+)-trans-2-(1-Methyl-1-phenylethyl)cyclohexanol, 98%
- DTXSID00450485
- J-002300
- SCHEMBL3276227
- (1S,2R)-2-(2-PHENYLPROPAN-2-YL)CYCLOHEXAN-1-OL
- 109527-45-9
-
- Inchi： 1S/C15H22O/c1-15(2,12-8-4-3-5-9-12)13-10-6-7-11-14(13)16/h3-5,8-9,13-14,16H,6-7,10-11H2,1-2H3/t13-,14-/m0/s1
- InChI Key： CTYOSJAXQPHWCK-KBPBESRZSA-N
- SMILES： O[C@H]1CCCC[C@@H]1C(C)(C)C1C=CC=CC=1
Computed Properties
- Exact Mass: 218.16716
- Monoisotopic Mass: 218.167065321g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 16
- Rotatable Bond Count: 2
- Complexity: 216
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 2
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Surface Charge: 0
- Tautomer Count: nothing
- XLogP3: 4.1
- Topological Polar Surface Area: 20.2?2
Experimental Properties
- Color/Form: liquid
- Density: 1.008?g/mL?at 25?°C(lit.)
- Boiling Point: 300?°C(lit.)
- Flash Point: >230?°F
- Refractive Index: n20/D 1.541(lit.)
- PSA: 20.23
- LogP: 3.51530
- Solubility: Not determined
Cyclohexanol,2-(1-methyl-1-phenylethyl)-, (1S,2R)- Related Literature
-
Cheng Fang,Jinjian Wu,Zahra Sobhani,Md. Al Amin,Youhong Tang Anal. Methods, 2019,11, 163-170
-
Jingquan Liu,Huiyun Liu,Zhongfan Jia,Volga Bulmus,Thomas P. Davis Chem. Commun., 2008, 6582-6584
-
Alvin Tanudjaja,Shinsuke Inagi,Fusao Kitamura,Toshikazu Takata,Ikuyoshi Tomita Dalton Trans., 2021,50, 3037-3043
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