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Cyclohexanol, 4-ethyl- (4534-74-1)

Identification
Name:Cyclohexanol, 4-ethyl-
Synonyms:4-Ethylcyclohexanol;NSC 21118;
CAS:4534-74-1
EINECS: 224-878-1
Molecular Formula: C8H16O
Molecular Weight: 128.212
InChI: InChI=1/C8H16O/c1-2-7-3-5-8(9)6-4-7/h7-9H,2-6H2,1H3
Molecular Structure: (C8H16O) 4-Ethylcyclohexanol;NSC 21118;
Properties
Flash Point: 77 ºC
Density:0.889
Refractive index:1.461-1.463
Appearance:clear very slight yellow liquid
Specification:

The 4-Ethylcyclohexanol with cas registry number of 4534-74-1, belongs to the following product categories: (1)Alcohols; (2)C7 to C8; (3)Oxygen Compounds. It has the systematic name of 4-ethylcyclohexanol. And its IUPAC name is 4-ethylcyclohexan-1-ol. When use it, avoid contact with skin and eyes.

Physical properties about this chemical are: (1)ACD/LogP: 2.36; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.36; (4)ACD/LogD (pH 7.4): 2.36; (5)ACD/BCF (pH 5.5): 36.88; (6)ACD/BCF (pH 7.4): 36.88; (7)ACD/KOC (pH 5.5): 460.37; (8)ACD/KOC (pH 7.4): 460.37; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 9.23 Å2; (13)Index of Refraction: 1.459; (14)Molar Refractivity: 38.58 cm3; (15)Molar Volume: 141 cm3; (16)Polarizability: 15.29×10-24cm3; (17)Surface Tension: 30.3 dyne/cm; (18)Enthalpy of Vaporization: 49.1 kJ/mol; (19)Vapour Pressure: 0.194 mmHg at 25°C.

You can still convert the following datas into molecular structure: 
(1)SMILES: OC1CCC(CC)CC1;
(2)InChI: InChI=1/C8H16O/c1-2-7-3-5-8(9)6-4-7/h7-9H,2-6H2,1H3;
(3)InChIKey: RVTKUJWGFBADIN-UHFFFAOYAN;
(4)Std. InChI: InChI=1S/C8H16O/c1-2-7-3-5-8(9)6-4-7/h7-9H,2-6H2,1H3;
(5)Std. InChIKey: RVTKUJWGFBADIN-UHFFFAOYSA-N

Flash Point: 77 ºC
Safety Data