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CAS No.: | 97272-02-1 |
---|---|
Name: | 5-PHENYL-2-THIOPHENESULFONYL CHLORIDE |
Article Data: | 5 |
Molecular Structure: | |
Formula: | C10H7ClO2S2 |
Molecular Weight: | 258.749 |
Synonyms: | 2-Chlorosulfonyl-5-phenylthiophene;5-Phenylthiophene-2-sulfonyl chloride; |
Density: | 1.43 g/cm3 |
Melting Point: | 85-87 °C |
Boiling Point: | 397.4 °C at 760 mmHg |
Flash Point: | 194.1 °C |
Hazard Symbols: | C |
Risk Codes: | 36 |
Safety: | 26 |
PSA: | 70.76000 |
LogP: | 4.42340 |
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The 2-Thiophenesulfonylchloride, 5-phenyl- is an organic compound with the formula C10H7ClO2S2. The systematic name of this chemical is 5-phenylthiophene-2-sulfonyl chloride. With the CAS registry number 97272-02-1, it is also named as 5-phenyl-2-thiophenesulfonyl chloride.
Physical properties about 2-Thiophenesulfonylchloride, 5-phenyl- are: (1)ACD/LogP: 3.95; (2)ACD/LogD (pH 5.5): 3.95; (3)ACD/LogD (pH 7.4): 3.95; (4)ACD/BCF (pH 5.5): 590.86; (5)ACD/BCF (pH 7.4): 590.86; (6)ACD/KOC (pH 5.5): 3352.99; (7)ACD/KOC (pH 7.4): 3352.99; (8)#H bond acceptors: 2; (9)#Freely Rotating Bonds: 2; (10)Polar Surface Area: 70.76 Å2; (11)Index of Refraction: 1.616; (12)Molar Refractivity: 63.24 cm3; (13)Molar Volume: 180.8 cm3; (14)Polarizability: 25.07×10-24cm3; (15)Surface Tension: 49.2 dyne/cm; (16)Density: 1.43 g/cm3; (17)Flash Point: 194.1 °C; (18)Enthalpy of Vaporization: 62.26 kJ/mol; (19)Boiling Point: 397.4 °C at 760 mmHg; (20)Vapour Pressure: 3.65E-06 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=S(Cl)(=O)c1ccc(s1)c2ccccc2
(2)InChI: InChI=1/C10H7ClO2S2/c11-15(12,13)10-7-6-9(14-10)8-4-2-1-3-5-8/h1-7H
(3)InChIKey: NHRKTBLHJKMFTP-UHFFFAOYAI
(4)Std. InChI: InChI=1S/C10H7ClO2S2/c11-15(12,13)10-7-6-9(14-10)8-4-2-1-3-5-8/h1-7H
(5)Std. InChIKey: NHRKTBLHJKMFTP-UHFFFAOYSA-N