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CAS No.: | 170727-02-3 |
---|---|
Name: | 3-Bromothiophene-2-sulphonyl chloride |
Article Data: | 16 |
Molecular Structure: | |
Formula: | C4H2BrClO2S2 |
Molecular Weight: | 261.548 |
Synonyms: | 3-Bromothiophene-2-sulfonylchloride; |
Density: | 1.985 g/cm3 |
Melting Point: | 39-41.5 °C |
Boiling Point: | 320.926 °C at 760 mmHg |
Flash Point: | 147.891 °C |
Hazard Symbols: | C, T |
Risk Codes: | C,T:Toxic/Corrosive; "> C,T:Toxic/Corrosive; |
PSA: | 70.76000 |
LogP: | 3.51890 |
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The 3-Bromothiophene-2-sulfonyl chloride is an organic compound with the formula C4H2BrClO2S2. The systematic name of this chemical is 3-Bromothiophene-2-sulfonyl chloride. With the CAS registry number 170727-02-3, it is also named as (3-Bromo(2-thienyl))chlorosulfone. Besides, its molecular weight is 261.5445.
Physical properties about 3-Bromothiophene-2-sulfonyl chloride are: (1)ACD/LogP: 1.72; (2)ACD/LogD (pH 5.5): 2; (3)ACD/LogD (pH 7.4): 2; (4)ACD/BCF (pH 5.5): 25; (5)ACD/BCF (pH 7.4): 25; (6)ACD/KOC (pH 5.5): 351; (7)ACD/KOC (pH 7.4): 351; (8)#H bond acceptors: 2; (9)#Freely Rotating Bonds: 1; (10)Polar Surface Area: 70.76 Å2; (11)Index of Refraction: 1.62; (12)Molar Refractivity: 46.263 cm3; (13)Molar Volume: 131.753 cm3; (14)Polarizability: 18.34×10-24 cm3; (15)Surface Tension: 54.583 dyne/cm; (16)Density: 1.985 g/cm3; (17)Flash Point: 147.891 °C; (18)Enthalpy of Vaporization: 54.026 kJ/mol; (19)Boiling Point: 320.926 °C at 760 mmHg; (20)Vapour Pressure: 0.001 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1)InChI: InChI=1/C4H2BrClO2S2/c5-3-1-2-9-4(3)10(6,7)8/h1-2H
(2)InChIKey: OPLMNCCLQDVCTP-UHFFFAOYAZ
(3)Std. InChI: InChI=1S/C4H2BrClO2S2/c5-3-1-2-9-4(3)10(6,7)8/h1-2H
(4)Std. InChIKey: OPLMNCCLQDVCTP-UHFFFAOYSA-N