Cyclohexanol,2-(1,1-dimethylethyl)-, (1S,2R)- supplier

Name
(-)-TRANS-2-TERT-BUTYLCYCLOHEXANOL
EINECS
CAS No. 13492-07-4
Article Data8
CAS DataBase
Density 0.92 g/cm³
Solubility
Melting Point
Formula C₁₀H₂₀O
Boiling Point 206.9 °C at 760 mmHg
Molecular Weight 156.268
Flash Point 79.4 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Cyclohexanol,2-(1,1-dimethylethyl)-, (1S-trans)-;Cyclohexanol, 2-tert-butyl-, trans-(+)-(8CI);
PSA 20.23000
LogP 2.58360

Cyclohexanol,2-(1,1-dimethylethyl)-, (1S,2R)- Specification

The Cyclohexanol,2-(1,1-dimethylethyl)-, (1S,2R)-, with CAS registry number 13492-07-4, has the systematic name of (1S,2R)-2-tert-butylcyclohexanol. Besides this, it is also called (-)-Trans-2-tert-butylcyclohexanol. And the chemical formula of this chemical is C₁₀H₂₀O.

Physical properties of Cyclohexanol,2-(1,1-dimethylethyl)-, (1S,2R)-: (1)ACD/LogP: 3.06; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 1; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 9.23 Å²; (7)Index of Refraction: 1.471; (8)Molar Refractivity: 47.45 cm³; (9)Molar Volume: 169.6 cm³; (10)Polarizability: 18.81×10^-24cm³; (11)Surface Tension: 34.1 dyne/cm; (12)Density: 0.92 g/cm³; (13)Flash Point: 79.4 °C; (14)Enthalpy of Vaporization: 51.55 kJ/mol; (15)Boiling Point: 206.9 °C at 760 mmHg; (16)Vapour Pressure: 0.0543 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O[C@@H]1[C@@H](C(C)(C)C)CCCC1
(2)InChI: InChI=1/C10H20O/c1-10(2,3)8-6-4-5-7-9(8)11/h8-9,11H,4-7H2,1-3H3/t8-,9-/m0/s1
(3)InChIKey: DLTWBMHADAJAAZ-IUCAKERBBC
(4)Std. InChI: InChI=1S/C10H20O/c1-10(2,3)8-6-4-5-7-9(8)11/h8-9,11H,4-7H2,1-3H3/t8-,9-/m0/s1
(5)Std. InChIKey: DLTWBMHADAJAAZ-IUCAKERBSA-N

Product Name

(-)-TRANS-2-TERT-BUTYLCYCLOHEXANOL

Cyclohexanol,2-(1,1-dimethylethyl)-, (1S,2R)- Specification

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