Molecular Structure of 2-Fluorothioanisole (CAS NO.655-20-9):
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: 57.8 °C
Enthalpy of Vaporization: 39.16 kJ/mol
Boiling Point: 172 °C at 760 mmHg
Vapour Pressure: 1.81 mmHg at 25°C
Sensitive: Stench
SMILES: Fc1ccccc1SC
InChI: InChI=1/C7H7FS/c1-9-7-5-3-2-4-6(7)8/h2-5H,1H3
Hazard Codes: Xi
Risk Statements: 36/37/38
R36/37/38:Irritating to eyes, respiratory system and skin.
Safety Statements: 26-36
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S36:Wear suitable protective clothing.
WGK Germany: 3
Hazard Note: Irritant/Stench
HazardClass: Irritant/Stench
2-Fluorothioanisole , with CAS number of 655-20-9, can be called benzene, 1-fluoro-2-(methylthio)- ; 1-Fluoro-2-(methylsulfanyl)benzene ; 2-Fluorophenyl methyl sulfide .
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