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CAS No.: | 19837-81-1 |
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Name: | 4-AMINO-N-(3-CHLORO-PHENYL)-BENZENESULFONAMIDE |
Article Data: | 5 |
Molecular Structure: | |
Formula: | C12H11ClN2O2S |
Molecular Weight: | 282.751 |
Synonyms: | Sulfanilanilide,3'-chloro- (6CI,7CI,8CI);N-(3-Chlorophenyl) 4-aminobenzenesulfonamide; |
Density: | 1.466 g/cm3 |
Boiling Point: | 467 °C at 760 mmHg |
Flash Point: | 236.3 °C |
PSA: | 80.57000 |
LogP: | 4.45800 |
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The CAS registry number of Benzenesulfonamide,4-amino-N-(3-chlorophenyl)- is 19837-81-1. This chemical is also named as [(4-Aminophenyl)sulfonyl](3-chlorophenyl)amine. In addition, its molecular formula is C12H11ClN2O2S and molecular weight is 282.7459. Its systematic name and IUPAC name are the same which is called 4-amino-N-(3-chlorophenyl)benzenesulfonamide.
Physical properties about Benzenesulfonamide,4-amino-N-(3-chlorophenyl)- are: (1)ACD/LogP: 2.59; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 4; (4)#H bond donors: 3; (5)#Freely Rotating Bonds: 3; (6)Index of Refraction: 1.674; (7)Molar Refractivity: 72.37 cm3; (8)Molar Volume: 192.7 cm3; (9)Surface Tension: 66.4 dyne/cm; (10)Density: 1.466 g/cm3; (11)Flash Point: 236.3 °C; (12)Enthalpy of Vaporization: 72.89 kJ/mol; (13)Boiling Point: 467 °C at 760 mmHg.
You can still convert the following datas into molecular structure:
(1)SMILES: Clc2cc(NS(=O)(=O)c1ccc(N)cc1)ccc2
(2)InChI: InChI=1/C12H11ClN2O2S/c13-9-2-1-3-11(8-9)15-18(16,17)12-6-4-10(14)5-7-12/h1-8,15H,14H2
(3)InChIKey: ZVOMLEQGMOLOEM-UHFFFAOYAJ