CAS No.62547-11-9,5-(4-CHLORO-PHENYLSULFAMOYL)-2-HYDROXY-BENZOIC ACID Suppliers

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Basic Information

Molecular Structure:
CAS No.:	62547-11-9
Name:	5-(4-CHLORO-PHENYLSULFAMOYL)-2-HYDROXY-BENZOIC ACID

Formula:	C₁₃H₉ClNO₅S^-
Molecular Weight:	327.745
Synonyms:	ZINC02624943;
Density:	1.626g/cm³
Boiling Point:	551.4 °C at 760 mmHg
Flash Point:	287.3 °C
PSA:	112.08000
LogP:	3.69840

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Specification

The 5-[(4-Chlorophenyl)sulfamoyl]-2-hydroxy-benzoate, with the CAS registry number of 62547-11-9, is also known as ZINC02624943. This chemical's molecular formula is C₁₃H₉ClNO₅S^- and molecular weight is 326.7328.

Physical properties about 5-[(4-Chlorophenyl)sulfamoyl]-2-hydroxy-benzoate are: (1)ACD/LogP: 4.61; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.5; (4)ACD/LogD (pH 7.4): 1.43; (5)ACD/BCF (pH 5.5): 1.46; (6)ACD/BCF (pH 7.4): 1.24; (7)ACD/KOC (pH 5.5): 5.95; (8)ACD/KOC (pH 7.4): 5.04; (9)#H bond acceptors: 6; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 92.29 Å²; (13)Flash Point: 287.3 °C; (14)Enthalpy of Vaporization: 87.52 kJ/mol; (15)Boiling Point: 551.4 °C at 760 mmHg; (16)Vapour Pressure: 5.43E-13 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: Clc2ccc(NS(=O)(=O)c1cc(C([O-])=O)c(O)cc1)cc2
(2) InChI: InChI=1/C13H10ClNO5S/c14-8-1-3-9(4-2-8)15-21(19,20)10-5-6-12(16)11(7-10)13(17)18/h1-7,15-16H,(H,17,18)/p-1
(3) InChIKey: JSSWUGKMGVSLDV-REWHXWOFAQ