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54714-33-9

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Basic Information
CAS No.: 54714-33-9
Name: 2-Methylcyclohexanol acetate
Article Data: 4
Molecular Structure:
Molecular Structure of 54714-33-9 (2-Methylcyclohexanol acetate)
Formula: C9H16O2
Molecular Weight: 156.225
Synonyms: Cyclohexanol,2-methyl-, acetate, cis-;(?à)-cis-2-Methylcyclohexyl acetate;cis-(?à)-2-Methylcyclohexyl acetate;cis-2-Methylcyclohexanolacetate;cis-2-Methylcyclohexyl acetate;
EINECS: 227-231-1
Density: 0.95 g/cm3
Boiling Point: 191.7 °C at 760 mmHg
Flash Point: 66.3 °C
PSA: 26.30000
LogP: 2.12820
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Specification

The 2-Methylcyclohexanol acetate ,its cas register number is 54714-33-9.It also can be called as Cyclohexanol,2-methyl-, acetate, (1R,2S)-rel- (9CI) and the Systematic name about this chemical is 2-Methylcyclohexyl acetate .It can be used for the production of hydrogen peroxide solvent system, used to dissolve organic quinones, it can also be used for other reaction solvents.

Following are the chemical properties about 2-Methylcyclohexanol acetate :(1)#H bond acceptors: 2 ; (2)#H bond donors: 0 ; (3)#Freely Rotating Bonds: 2 ; (4)Polar Surface Area: 26.3 Å2 ; (5)Index of Refraction: 1.444 ; (6)Molar Refractivity: 43.48 cm3 ; (7)Molar Volume: 163.4 cm3 ; (8)Polarizability: 17.23x10-24cm3 ; (9)Surface Tension: 29.9 dyne/cm; (10)Enthalpy of Vaporization: 42.79 kJ/mol ; (11)Vapour Pressure: 0.508 mmHg at 25°C

This chemical can be described computed from structure:
(1)SMILES: O=C(OC1CCCCC1C)C
(2)InChI: InChI=1/C9H16O2/c1-7-5-3-4-6-9(7)11-8(2)10/h7,9H,3-6H2,1-2H3
(3)InChIKey: AKIIJALHGMKJEJ-UHFFFAOYAG
(4)Std. InChI: InChI=1S/C9H16O2/c1-7-5-3-4-6-9(7)11-8(2)10/h7,9H,3-6H2,1-2H3
(5)Std. InChIKey: AKIIJALHGMKJEJ-UHFFFAOYSA-N