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64568-19-0

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Basic Information
CAS No.: 64568-19-0
Name: chloromethyl dichloromethyl sulfone
Molecular Structure:
Molecular Structure of 64568-19-0 (chloromethyl dichloromethyl sulfone)
Formula: C2H3Cl3O2S
Molecular Weight: 197.47
Synonyms: Chloromethyl dichloromethyl sulfone;
Density: 1.686 g/cm3
Boiling Point: 336.3 °C at 760 mmHg
Flash Point: 157.2 °C
PSA: 42.52000
LogP: 2.43950
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    chloromethyl dichloromethyl sulfone

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Specification

The Methane,dichloro[(chloromethyl)sulfonyl]-, with the CAS registry number of 64568-19-0, is also known as Chloromethyl dichloromethyl sulfone. Its molecular formula is C2H3Cl3O2S and molecular weight is 197.468. What's more, its IUPAC name is Dichloro(chloromethylsulfonyl)methane.

Physical properties about the Methane,dichloro[(chloromethyl)sulfonyl]- are: (1)ACD/LogP: 0.88; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.88; (4)ACD/LogD (pH 7.4): 0.88; (5)ACD/BCF (pH 5.5): 2.73; (6)ACD/BCF (pH 7.4): 2.73; (7)ACD/KOC (pH 5.5): 71.5; (8)ACD/KOC (pH 7.4): 71.5; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 42.52 Å2; (13)Index of Refraction: 1.502; (14)Molar Refractivity: 34.59 cm3; (15)Molar Volume: 117.1 cm3; (16)Surface Tension: 47.6 dyne/cm; (17)Density: 1.686 g/cm3; (18)Flash Point: 157.2 °C; (19)Enthalpy of Vaporization: 55.65 kJ/mol; (20)Boiling Point: 336.3 °C at 760 mmHg; (21)Vapour Pressure: 0.00022 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: ClC(Cl)S(=O)(=O)CCl
(2) InChI: InChI=1/C2H3Cl3O2S/c3-1-8(6,7)2(4)5/h2H,1H2
(3) InChIKey: GKWWRFYDQONRHI-UHFFFAOYAZ.