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2',5'-Dichloro-2,2,2-trifluoroacetophenone

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Name

2',5'-Dichloro-2,2,2-trifluoroacetophenone

EINECS N/A
CAS No. 886371-22-8 Density 1.506 g/cm3
PSA 17.07000 LogP 3.73840
Solubility N/A Melting Point N/A
Formula C8H3Cl2F3O Boiling Point 225.8 °C at 760 mmHg
Molecular Weight 243.012 Flash Point 90.4 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 886371-22-8 (1-(2,5-DICHLORO-PHENYL)-2,2,2-TRIFLUORO-ETHANONE) Hazard Symbols N/A
Synonyms

1-(2,5-dichloro-phenyl)-2,2,2-trifluoro-ethanone;

Article Data 6

2',5'-Dichloro-2,2,2-trifluoroacetophenone Specification

The 2',5'-Dichloro-2,2,2-trifluoroacetophenone with the CAS number 886371-22-8 is also called 1-(2,5-dichloro-phenyl)-2,2,2-trifluoro-ethanone. Its molecular formula is C8H3Cl2F3O. This chemical is a kind of organics. It should be stored in dry and cool environment.

The properties of the chemical are: (1)ACD/LogP: 3.35; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.35; (4)ACD/LogD (pH 7.4): 3.35; (5)#H bond acceptors: 1; (6)#H bond donors: 0; (7)#Freely Rotating Bonds: 1; (8)Polar Surface Area: 17.07 Å2; (9)Index of Refraction: 1.488; (10)Molar Refractivity: 46.52 cm3; (11)Molar Volume: 161.2 cm3; (12)Polarizability: 18.44×10-24cm3; (13)Surface Tension: 33.4 dyne/cm; (14)Enthalpy of Vaporization: 46.23 kJ/mol; (15)Vapour Pressure: 0.0848 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(c1cc(Cl)ccc1Cl)C(F)(F)F
(2)InChI: InChI=1/C8H3Cl2F3O/c9-4-1-2-6(10)5(3-4)7(14)8(11,12)13/h1-3H
(3)InChIKey: HXPJKNUPFSLMBO-UHFFFAOYAG

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