Name: 1-CHLORO-4-HYDROXYCYCLOHEXANE
SKU: 30485-71-3

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Basic Information

Molecular Structure:
CAS No.:	30485-71-3
Name:	1-CHLORO-4-HYDROXYCYCLOHEXANE
Article Data:	4

Formula:	C₆H₁₁ClO
Molecular Weight:	134.606
Synonyms:	4-Chlorocyclohexanol;
Density:	1.12g/cm³
Boiling Point:	218.3 °C at 760 mmHg
Flash Point:	85.8 °C
Risk Codes:	10
Safety:	16-26-36/37/39
Transport Information:	UN 1987
PSA:	20.23000
LogP:	1.52870

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Specification

The Cyclohexanol, 4-chloro-, with CAS registry number 30485-71-3, has the systematic name of 4-chlorocyclohexanol. Besides this, it is also called 1-Chloro-4-hydroxycyclohexane. And the chemical formula of this chemical is C₆H₁₁ClO.

Physical properties of Cyclohexanol, 4-chloro-: (1)ACD/LogP: 1.14; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.14; (4)ACD/LogD (pH 7.4): 1.14; (5)ACD/BCF (pH 5.5): 4.31; (6)ACD/BCF (pH 7.4): 4.31; (7)ACD/KOC (pH 5.5): 99.08; (8)ACD/KOC (pH 7.4): 99.08; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 9.23 Å²; (13)Index of Refraction: 1.482; (14)Molar Refractivity: 34.1 cm³; (15)Molar Volume: 119.4 cm³; (16)Polarizability: 13.51×10^-24cm³; (17)Surface Tension: 36 dyne/cm; (18)Density: 1.12 g/cm³; (19)Flash Point: 85.8 °C; (20)Enthalpy of Vaporization: 52.87 kJ/mol; (21)Boiling Point: 218.3 °C at 760 mmHg; (22)Vapour Pressure: 0.027 mmHg at 25°C.

Preparation: this chemical can be prepared by cyclohexane-1,4-diol. This reaction will need reagent aq. HCl.

Uses of Cyclohexanol, 4-chloro-: it can be used to produce 4-chloro-cyclohexanone. This reaction will need reagent CrO₃.

When you are using this chemical, please be cautious about it as the following:
The Cyclohexanol, 4-chloro- is flammable, so keep it away from sources of ignition. When use it, wear suitable protective clothing, gloves and eye/face protection.

You can still convert the following datas into molecular structure:
(1)SMILES: ClC1CCC(O)CC1
(2)InChI: InChI=1/C6H11ClO/c7-5-1-3-6(8)4-2-5/h5-6,8H,1-4H2
(3)InChIKey: HVPIAXWCSPHTAY-UHFFFAOYAO
(4)Std. InChI: InChI=1S/C6H11ClO/c7-5-1-3-6(8)4-2-5/h5-6,8H,1-4H2
(5)Std. InChIKey: HVPIAXWCSPHTAY-UHFFFAOYSA-N