Phenol,2-chloro-6-cyclohexyl-4-nitro- supplier

Name
2-chloro-6-cyclohexyl-4-nitrophenol
EINECS 254-355-3
CAS No. 39206-13-8
Density 1.325 g/cm³
Solubility
Melting Point
Formula C₁₂H₁₄ClNO₃
Boiling Point 313.9 °C at 760 mmHg
Molecular Weight 255.701
Flash Point 143.7 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2-Cyclohexyl-4-nitro-6-chlorophenol;2-Chloro-6-cyclohexyl-4-nitrophenol;
PSA 66.05000
LogP 4.52470

Phenol,2-chloro-6-cyclohexyl-4-nitro- Specification

The Phenol,2-chloro-6-cyclohexyl-4-nitro-, with the CAS registry number 39206-13-8, is also known as 2-Cyclohexyl-4-nitro-6-chlorophenol. This chemical's molecular formula is C₁₂H₁₄ClNO₃ and molecular weight is 255.70. What's more, its systematic name is 2-Chloro-6-cyclohexyl-4-nitrophenol and its EINECS number is 254-355-3.

Physical properties of Phenol,2-chloro-6-cyclohexyl-4-nitro- are: (1)ACD/LogP: 4.74; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.42; (4)ACD/LogD (pH 7.4): 2.83; (5)ACD/BCF (pH 5.5): 1136.72; (6)ACD/BCF (pH 7.4): 28.9; (7)ACD/KOC (pH 5.5): 4351.59; (8)ACD/KOC (pH 7.4): 110.62; (9)#H bond acceptors: 4; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 55.05 Å²; (13)Index of Refraction: 1.593; (14)Molar Refractivity: 65.43 cm³; (15)Molar Volume: 192.8 cm³; (16)Polarizability: 25.94×10^-24cm³; (17)Surface Tension: 52.8 dyne/cm; (18)Density: 1.325 g/cm³; (19)Flash Point: 143.7 °C; (20)Enthalpy of Vaporization: 57.72 kJ/mol; (21)Boiling Point: 313.9 °C at 760 mmHg; (22)Vapour Pressure: 0.000261 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1CCC(CC1)C2=CC(=CC(=C2O)Cl)[N+](=O)[O-]
(2)InChI: InChI=1S/C12H14ClNO3/c13-11-7-9(14(16)17)6-10(12(11)15)8-4-2-1-3-5-8/h6-8,15H,1-5H2
(3)InChIKey: HOVSIVIXNWEURQ-UHFFFAOYSA-N

Product Name

2-chloro-6-cyclohexyl-4-nitrophenol

Phenol,2-chloro-6-cyclohexyl-4-nitro- Specification

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