Molecular Structure of 3-Fluorophenylacetone (CAS NO.1737-19-5):
IUPAC Name: 1-(3-fluorophenyl)propan-2-one
Empirical Formula: C9H9FO
Molecular Weight: 152.1656
H bond acceptors: 1
H bond donors: 0
Freely Rotating Bonds: 2
Polar Surface Area: 17.07 Å2
Index of Refraction: 1.489
Molar Refractivity: 40.45 cm3
Molar Volume: 140 cm3
Surface Tension: 33 dyne/cm
Density: 1.086 g/cm3
Flash Point: 82.8 °C
Enthalpy of Vaporization: 43.55 kJ/mol
Boiling Point: 199.3 °C at 760 mmHg
Vapour Pressure: 0.345 mmHg at 25°C
InChI
InChI=1/C9H9FO/c1-7(11)5-8-3-2-4-9(10)6-8/h2-4,6H,5H2,1H3
Smiles
c1(CC(=O)C)cc(F)ccc1
Product Categories: Aromatic Ketones (substituted)
Hazard Codes F,Xi
Risk Statements 36/37/38
R36/37/38:Irritating to eyes, respiratory system and skin.
Safety Statements 24/25
S24/25:Avoid contact with skin and eyes.
Hazard Note Flammable
HazardClass Irritant, Flammable
3-Fluorophenylacetone , with CAS number of 1737-19-5, can be called 1-(3-Fluorophenyl)acetone ; 2-propanone, 1-(3-fluorophenyl)- ; 3-Fluorophenyl-2-propanone ; 3-Fluorophenylacetone 97% . It is a clear yellow-green liquid.
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