1-Hydroxy-3-cyclohexene supplier

Name
1-Hydroxy-3-cyclohexene
EINECS
CAS No. 822-66-2
Article Data49
CAS DataBase
Density 1.014g/cm³
Solubility
Melting Point
Formula C₆H₁₀O
Boiling Point 164.5 °C at 760 mmHg
Molecular Weight 98.1448
Flash Point 53.4 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 3-Cyclohexen-1-ol,(?à)-;1-Cyclohexen-4-ol;3-Cyclohexenol;4-Hydroxycyclohexene;
PSA 20.23000
LogP 1.08740

1-Hydroxy-3-cyclohexene Specification

The 1-Hydroxy-3-cyclohexene, with cas registry number 822-66-2, has the systematic name of cyclohex-3-en-1-ol. And it is also named 3-cyclohexen-1-ol.

Physical properties about this chemical are: (1)ACD/LogP: 0.98; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.98; (4)ACD/LogD (pH 7.4): 0.98; (5)ACD/BCF (pH 5.5): 3.29; (6)ACD/BCF (pH 7.4): 3.29; (7)ACD/KOC (pH 5.5): 81.57; (8)ACD/KOC (pH 7.4): 81.57; (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: 1.508; (14)Molar Refractivity: 28.86 cm³; (15)Molar Volume: 96.7 cm³; (16)Polarizability: 11.44×10^-24cm³; (17)Surface Tension: 36.8 dyne/cm; (18)Enthalpy of Vaporization: 46.7 kJ/mol; (19)Vapour Pressure: 0.662 mmHg at 25°C.

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

Uses of 1-Hydroxy-3-cyclohexene: it can be used to produce acetic acid cyclohex-3-enyl ester. The yield of this reaction is about 65 % .

You can still convert the following datas into molecular structure:
(1)SMILES: OC1C/C=C\CC1
(2)InChI: InChI=1/C6H10O/c7-6-4-2-1-3-5-6/h1-2,6-7H,3-5H2
(3)InChIKey: ABZZOPIABWYXSN-UHFFFAOYAC
(4)Std. InChI: InChI=1S/C6H10O/c7-6-4-2-1-3-5-6/h1-2,6-7H,3-5H2
(5)Std. InChIKey: ABZZOPIABWYXSN-UHFFFAOYSA-N

Product Name

1-Hydroxy-3-cyclohexene

1-Hydroxy-3-cyclohexene Specification

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