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3,4-Difluorobenzenesulfonamide

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Name

3,4-Difluorobenzenesulfonamide

EINECS N/A
CAS No. 108966-71-8 Density 1.523 g/cm3
PSA 68.54000 LogP 2.39330
Solubility N/A Melting Point 89-93 °C(lit.)
Formula C6H5F2NO2S Boiling Point 314.4 °C at 760 mmHg
Molecular Weight 193.174 Flash Point 143.9 °C
Transport Information N/A Appearance N/A
Safety 24/25 Risk Codes  Xi:Irritant;
Molecular Structure Molecular Structure of 108966-71-8 (3,4-DIFLUOROBENZENESULFONAMIDE) Hazard Symbols IrritantXi
Synonyms

3,4-DIFLUOROBENZENESULFONAMIDE;3,4-DIFLUOROBENZENESULPHONAMIDE;BUTTPARK 21\07-17;Benzenesulfonamide, 3,4-difluoro- (9CI)

Article Data 3

3,4-Difluorobenzenesulfonamide Specification

The 3,4-Difluorobenzenesulfonamide with its cas register number is 108966-71-8. It also can be called as Benzenesulfonamide,3,4-difluoro- and the IUPAC Name about this chemical is 3,4-difluorobenzenesulfonamide. It belongs to the following product categories, such as Sulfonamide, Organic Building Blocks, Sulfonamides/Sulfinamides, Sulfur Compounds and so on. When you are using it, please avoid contact with skin and eyes.

Physical properties about 3,4-Difluorobenzenesulfonamide are: (1)ACD/LogP: 0.97; (2)ACD/LogD (pH 5.5): 0.97; (3)ACD/LogD (pH 7.4): 0.97; (4)ACD/BCF (pH 5.5): 3.22; (5)ACD/BCF (pH 7.4): 3.2; (6)ACD/KOC (pH 5.5): 80.32; (7)ACD/KOC (pH 7.4): 80; (8)#H bond acceptors: 3; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 1; (11)Polar Surface Area: 45.76Å2; (12)Index of Refraction: 1.534; (13)Molar Refractivity: 39.41 cm3; (14)Molar Volume: 126.8 cm3; (15)Polarizability: 15.62x10-24cm3; (16)Surface Tension: 44.6 dyne/cm; (17)Enthalpy of Vaporization: 55.55 kJ/mol; (18)Vapour Pressure: 0.000468 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CC(=C(C=C1S(=O)(=O)N)F)F
(2)InChI: InChI=1S/C6H5F2NO2S/c7-5-2-1-4(3-6(5)8)12(9,10)11/h1-3H,(H2,9,10,11)
(3)InChIKey: VFVVRYNJTGHAIE-UHFFFAOYSA-N

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