[(Difluoromethyl)sulfonyl]benzene supplier

Name
[(Difluoromethyl)sulfonyl]benzene
EINECS
CAS No. 1535-65-5
Article Data23
CAS DataBase
Density 1.349 g/cm³
Solubility Soluble in chloroform and water.
Melting Point 24-25℃
Formula C₇H₆F₂O₂S
Boiling Point 289.547 °C at 760 mmHg
Molecular Weight 192.186
Flash Point 128.914 °C
Transport Information
Appearance
Safety 26-24/25
Risk Codes 36/38
Molecular Structure
Hazard Symbols Xi
Synonyms Benzene, [(difluoromethyl)sulfonyl]-;Difluoromethyl phenyl sulfone;
PSA 42.52000
LogP 2.76370

[(Difluoromethyl)sulfonyl]benzene Specification

[(Difluoromethyl)sulfonyl]benzene is an organic compound with the formula C₇H₆F₂O₂S, and its systematic name is the same with the product name. With the CAS registry number 1535-65-5, it is also named as Benzene, [(difluoromethyl)sulfonyl]-. In addition, the molecular weight is 192.18.

Physical properties of [(Difluoromethyl)sulfonyl]benzene are: (1)ACD/LogP: 1.462; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.46; (4)ACD/LogD (pH 7.4): 1.46; (5)ACD/BCF (pH 5.5): 7.61; (6)ACD/BCF (pH 7.4): 7.61; (7)ACD/KOC (pH 5.5): 148.72; (8)ACD/KOC (pH 7.4): 148.72; (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: 1.479; (14)Molar Refractivity: 40.414 cm³; (15)Molar Volume: 142.483 cm³; (16)Polarizability: 16.021×10^-24cm³; (17)Surface Tension: 32.26 dyne/cm; (18)Density: 1.349 g/cm³; (19)Flash Point: 128.914 °C; (20)Enthalpy of Vaporization: 50.765 kJ/mol; (21)Boiling Point: 289.547 °C at 760 mmHg; (22)Vapour Pressure: 0.004 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=S(=O)(c1ccccc1)C(F)F
(2)Std. InChI: InChI=1S/C7H6F2O2S/c8-7(9)12(10,11)6-4-2-1-3-5-6/h1-5,7H
(3)Std. InChIKey: LRHDNAVPELLXDL-UHFFFAOYSA-N

Product Name

[(Difluoromethyl)sulfonyl]benzene

[(Difluoromethyl)sulfonyl]benzene Specification

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