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Benzenesulfonamide,N-chloro-

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Name

Benzenesulfonamide,N-chloro-

EINECS N/A
CAS No. 80-16-0 Density 1.42 g/cm3
PSA 54.55000 LogP 2.59040
Solubility N/A Melting Point 170-173oC
Formula C6H6ClNO2S Boiling Point 303.8 °C at 760 mmHg
Molecular Weight 191.638 Flash Point 137.6 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 80-16-0 (Chloramine-B) Hazard Symbols N/A
Synonyms

Benzenesulfochloramide;N-Chlorobenzenesulfonamide;Phenylsulfamyl chloride;

Article Data 7

Benzenesulfonamide,N-chloro- Specification

The Benzenesulfonamide,N-chloro- is an organic compound with the formula C6H6ClNO2S. The IUPAC name of this chemical is N-chlorobenzenesulfonamide. With the CAS registry number 80-16-0, it is also named as Chloramine-B. The product's classification codes are Anti-Infective Agents; Disinfectants.

Physical properties about Benzenesulfonamide,N-chloro- are: (1)ACD/LogP: 1.81; (2)ACD/LogD (pH 5.5): -0.18; (3)ACD/LogD (pH 7.4): -0.19; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 2.35; (7)ACD/KOC (pH 7.4): 2.3; (8)#H bond acceptors: 3; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 1; (11)Polar Surface Area: 45.76 Å2; (12)Index of Refraction: 1.566; (13)Molar Refractivity: 44.05 cm3; (14)Molar Volume: 134.9 cm3; (15)Polarizability: 17.46×10-24cm3; (16)Surface Tension: 45.5 dyne/cm; (17)Density: 1.42 g/cm3; (18)Flash Point: 137.6 °C; (19)Enthalpy of Vaporization: 54.42 kJ/mol; (20)Boiling Point: 303.8 °C at 760 mmHg; (21)Vapour Pressure: 0.000908 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=S(=O)(NCl)c1ccccc1
(2)InChI: InChI=1/C6H6ClNO2S/c7-8-11(9,10)6-4-2-1-3-5-6/h1-5,8H
(3)InChIKey: CHVZPRDGLWBEMJ-UHFFFAOYAI
(4)Std. InChI: InChI=1S/C6H6ClNO2S/c7-8-11(9,10)6-4-2-1-3-5-6/h1-5,8H
(5)Std. InChIKey: CHVZPRDGLWBEMJ-UHFFFAOYSA-N

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