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Basic Information
CAS No.: 658-28-6
Name: 3-Fluorothioanisole
Article Data: 4
Molecular Structure:
Molecular Structure of 658-28-6 (3-Fluorothioanisole)
Formula: C7H7FS
Molecular Weight: 142.197
Synonyms: Sulfide,m-fluorophenyl methyl (7CI,8CI);1-Fluoro-3-(methylthio)benzene;3-Fluorophenylmethyl sulfide;m-Fluorophenyl methyl sulfide;
Density: 1.13 g/cm3
Boiling Point: 177.5 °C at 760 mmHg
Flash Point: 61.2 °C
Hazard Symbols: IrritantXi
PSA: 25.30000
LogP: 2.54760
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    3-FLUOROTHIOANISOLE

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    3-Fluoro thioanisole

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    3-Fluorothioanisole

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    658-28-6

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Chemistry

Molecular Structure of 3-Fluorothioanisole (CAS NO.658-28-6):

Empirical Formula: C7H7FS
Molecular Weight: 142.1939
H bond acceptors: 0
H bond donors: 0
Freely Rotating Bonds: 1
Polar Surface Area: 25.3Å2
Index of Refraction: 1.544
Molar Refractivity: 39.5 cm3
Molar Volume: 125.1 cm3
Surface Tension: 34.5 dyne/cm
Density: 1.13 g/cm3
Flash Point: 61.2 °C
Enthalpy of Vaporization: 39.69 kJ/mol
Boiling Point: 177.5 °C at 760 mmHg
Vapour Pressure: 1.39 mmHg at 25°C
SMILES: Fc1cccc(SC)c1
InChI: InChI=1/C7H7FS/c1-9-7-4-2-3-6(8)5-7/h2-5H,1H3

Safety Profile

Hazard Codes: IrritantXi
Hazard Note: Irritant

Specification

 3-Fluorothioanisole , with CAS number of 658-28-6, can be called Sulfide,m-fluorophenyl methyl (7CI,8CI) ; 1-Fluoro-3-(methylthio)benzene ; 3-Fluorophenylmethyl sulfide ; m-Fluorophenyl methyl sulfide .