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Basic Information
CAS No.: 5502-75-0
Name: 4-(1-Methylethyl)cyclohexanemethanol
Molecular Structure:
Molecular Structure of 5502-75-0 (4-(1-Methylethyl)cyclohexanemethanol)
Formula: C10H20O
Molecular Weight: 156.268
Synonyms: 4-(1-Methylethyl)cyclohexanemethanol;
Density: 0.882 g/cm3
Boiling Point: 223.7 °C at 760 mmHg
Flash Point: 97.2 °C
PSA: 20.23000
LogP: 2.44110
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Specification

The 4-Isopropylcyclohexylmethanol is an organic compound with the formula C10H20O. The systematic name of this chemical is [4-(propan-2-yl)cyclohexyl]methanol. With the CAS registry number 5502-75-0, it is also named as cyclohexanemethanol, 4-(1-methylethyl)-.

Physical properties about 4-Isopropylcyclohexylmethanol are: (1)ACD/LogP: 3.24; (2)ACD/LogD (pH 5.5): 3.24; (3)ACD/LogD (pH 7.4): 3.24; (4)ACD/BCF (pH 5.5): 171.64; (5)ACD/BCF (pH 7.4): 171.64; (6)ACD/KOC (pH 5.5): 1384.03; (7)ACD/KOC (pH 7.4): 1384.03; (8)#H bond acceptors: 1; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 3; (11)Polar Surface Area: 9.23 Å2; (12)Index of Refraction: 1.451; (13)Molar Refractivity: 47.76 cm3; (14)Molar Volume: 177.1 cm3; (15)Polarizability: 18.93×10-24cm3; (16)Surface Tension: 29.2 dyne/cm; (17)Density: 0.882 g/cm3; (18)Flash Point: 97.2 °C; (19)Enthalpy of Vaporization: 53.5 kJ/mol; (20)Boiling Point: 223.7 °C at 760 mmHg; (21)Vapour Pressure: 0.0192 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: OCC1CCC(C(C)C)CC1
(2)InChI: InChI=1/C10H20O/c1-8(2)10-5-3-9(7-11)4-6-10/h8-11H,3-7H2,1-2H3
(3)InChIKey: KHWTYGFHPHRQMP-UHFFFAOYAR
(4)Std. InChI: InChI=1S/C10H20O/c1-8(2)10-5-3-9(7-11)4-6-10/h8-11H,3-7H2,1-2H3
(5)Std. InChIKey: KHWTYGFHPHRQMP-UHFFFAOYSA-N