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75820-58-5

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Basic Information
CAS No.: 75820-58-5
Name: 1-Chloro-4-(1,1,2,2-tetrafluoroethoxy)benzene
Molecular Structure:
Molecular Structure of 75820-58-5 (1-Chloro-4-(1,1,2,2-tetrafluoroethoxy)benzene)
Formula: C8H5ClF4O
Molecular Weight: 228.57
Synonyms: 1-Chloro-4-(1,1,2,2-tetrafluoroethoxy)benzene
Density: 1.392 g/cm3
Boiling Point: 194.4 °C at 760 mmHg
Flash Point: 71.4 °C
PSA: 9.23000
LogP: 3.57670
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Specification

The 4-(1,1,2,2-Tetrafluoroethoxy)chlorobenzene with cas registry number of 75820-58-5, has the systematic name of 1-chloro-4-(1,1,2,2-tetrafluoroethoxy)benzene. And it is also named 1-Chloro-4-(1,1,2,2-tetrafluoroethoxy)benzene.

Physical properties about this chemical are: (1)ACD/LogP: 4.08; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.08; (4)ACD/LogD (pH 7.4): 4.08; (5)ACD/BCF (pH 5.5): 746.04; (6)ACD/BCF (pH 7.4): 746.04; (7)ACD/KOC (pH 5.5): 3962.09; (8)ACD/KOC (pH 7.4): 3962.09; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 3; (12)Index of Refraction: 1.437; (13)Molar Refractivity: 43.03 cm3; (14)Molar Volume: 164.1 cm3; (15)Polarizability: 17.06×10-24cm3; (16)Surface Tension: 25.8 dyne/cm; (17)Enthalpy of Vaporization: 41.3 kJ/mol; (18)Vapour Pressure: 0.617 mmHg at 25°C.

You can still convert the following datas into molecular structure: 
(1)SMILES: Clc1ccc(OC(F)(F)C(F)F)cc1;
(2)InChI: InChI=1/C8H5ClF4O/c9-5-1-3-6(4-2-5)14-8(12,13)7(10)11/h1-4,7H;
(3)InChIKey: KBSCMSKBMYLURX-UHFFFAOYAS;
(4)Std. InChI: InChI=1S/C8H5ClF4O/c9-5-1-3-6(4-2-5)14-8(12,13)7(10)11/h1-4,7H;
(5)Std. InChIKey: KBSCMSKBMYLURX-UHFFFAOYSA-N