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CAS No. 1125-66-2 Density 1.145 g/cm3
PSA 20.23000 LogP 2.91640
Solubility 375.4mg/L(25 oC) Melting Point N/A
Formula C9H11ClO Boiling Point 267 °C at 760 mmHg
Molecular Weight 170.6404 Flash Point 115.2 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 1125-66-2 (4-CHLORO-3-ETHYL-5-METHYLPHENOL) Hazard Symbols N/A

Phenol, 4-chloro-3-ethyl-5-methyl-;


4-Chloro-3-ethyl-5-methyl-phenol Specification

The 4-Chloro-3-ethyl-5-methyl-phenol, with the CAS registry number of 1125-66-2, is also known as Phenol, 4-chloro-3-ethyl-5-methyl-. Its molecular formula is C9H11ClO and molecular weight is 170.6404. What's more, its IUPAC name is 4-Chloro-3-ethyl-5-methylphenol.

Physical properties about the 4-Chloro-3-ethyl-5-methyl-phenol are: (1)ACD/LogP: 3.88; (2)# of Rule of 5 Violations: 0 ; (3)#H bond acceptors: 1; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 9.23 Å2; (7)Index of Refraction: 1.549; (8)Molar Refractivity: 47.4 cm3; (9)Molar Volume: 148.9 cm3; (10)Surface Tension: 39.1 dyne/cm; (11)Density: 1.145 g/cm3; (12)Flash Point: 115.2 °C; (13)Enthalpy of Vaporization: 52.53 kJ/mol; (14)Boiling Point: 267 °C at 760 mmHg; (15)Vapour Pressure: 0.00509 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: Clc1c(cc(O)cc1CC)C
(2) InChI: InChI=1/C9H11ClO/c1-3-7-5-8(11)4-6(2)9(7)10/h4-5,11H,3H2,1-2H3

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