IUPAC Name: Sodium 4-fluorobenzenesulfinate
Synonyms of 4-Flurobenzenesulfinic acid sodium salt (CAS NO.824-80-6): Benzenesulfinic acid, p-fluoro-, sodium salt ; p-Fluorobenzenesulfinic acid sodium salt ; 4-Fluorobenzenesulfinic acidsodiumsalt
CAS NO:824-80-6
Molecular Formula: C6H4FNaO2S
Molecular Weight : 182.15
Molecular Structure:
H bond acceptors: 2
H bond donors: 1
Freely Rotating Bonds: 1
Polar Surface Area: 56.51Å2
Flash Point: 153.1°C
Enthalpy of Vaporization: 60.38 kJ/mol
Boiling Point: 329.5 °C at 760 mmHg
Vapour Pressure: 7.09E-05 mmHg at 25°C
Melting Point: >250°C
SMILES: [Na+].O=S([O-])c1ccc(F)cc1
InChI: InChI=1/C6H5FO2S.Na/c7-5-1-3-6(4-2-5)10(8)9;/h1-4H,(H,8,9);/q;+1/p-1
InChIKey: VDDUCRSPMBZLMH-REWHXWOFAC
Std. InChI: InChI=1S/C6H5FO2S.Na/c7-5-1-3-6(4-2-5)10(8)9;/h1-4H,(H,8,9);/q;+1/p-1
Std. InChIKey: VDDUCRSPMBZLMH-UHFFFAOYSA-M
Product Categories: Industrial/Fine Chemicals
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