4-Hydroxycyclohexylacetic acid supplier

Name
4-hydroxycyclohexylacetic acid
EINECS
CAS No. 99799-09-4
Article Data2
CAS DataBase
Density 1.166 g/cm³
Solubility
Melting Point 110-120 °C
Formula C₈H₁₄O₃
Boiling Point 326.439 °C at 760 mmHg
Molecular Weight 158.197
Flash Point 165.436 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2-(4-Hydroxycyclohexyl)acetic acid;(4-Hydroxycyclohexyl)acetic acid;
PSA 57.53000
LogP 1.01220

4-Hydroxycyclohexylacetic acid Specification

The 4-Hydroxycyclohexylacetic acid, with the CAS registry number 99799-09-4, is also known as 2-(4-Hydroxycyclohexyl)acetic acid. This chemical's molecular formula is C₈H₁₄O₃ and molecular weight is 158.20. What's more, its systematic name is (4-Hydroxycyclohexyl)acetic acid.

Physical properties of 4-Hydroxycyclohexylacetic acid are: (1)ACD/LogP: 0.261; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.62; (4)ACD/LogD (pH 7.4): -2.42; (5)ACD/BCF (pH 5.5): 1.00; (6)ACD/BCF (pH 7.4): 1.00; (7)ACD/KOC (pH 5.5): 4.38; (8)ACD/KOC (pH 7.4): 1.00; (9)#H bond acceptors: 3; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 57.53 Å²; (13)Index of Refraction: 1.503; (14)Molar Refractivity: 40.152 cm³; (15)Molar Volume: 135.638 cm³; (16)Polarizability: 15.918×10^-24cm³; (17)Surface Tension: 45.8129997253418 dyne/cm; (18)Density: 1.166 g/cm³; (19)Flash Point: 165.436 °C; (20)Enthalpy of Vaporization: 65.902 kJ/mol; (21)Boiling Point: 326.439 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: OC1CCC(CC(O)=O)CC1
(2)Std. InChI: InChI=1S/C8H14O3/c9-7-3-1-6(2-4-7)5-8(10)11/h6-7,9H,1-5H2,(H,10,11)
(3)Std. InChIKey: ALTAAUJNHYWOGS-UHFFFAOYSA-N

Product Name

4-hydroxycyclohexylacetic acid

4-Hydroxycyclohexylacetic acid Specification

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