Molecular Structure of 2'-(Trifluoromethyl)propiophenone (CAS NO.16185-96-9):

IUPAC Name: 1-[2-(Trifluoromethyl)phenyl]propan-1-one 
Molecular Formula: C₁₀H₉F₃O
Molecular Weight: 202.17 
XLogP3-AA: 3
H-Bond Donor: 0
H-Bond Acceptor: 4
Index of Refraction: 1.449
Molar Refractivity: 45.89 cm³
Molar Volume: 170.9 cm³
Surface Tension: 26.9 dyne/cm
Density: 1.182 g/cm³
Flash Point: 99.5 °C
Enthalpy of Vaporization: 46.24 kJ/mol
Boiling Point: 225.8 °C at 760 mmHg
Vapour Pressure: 0.0845 mmHg at 25 °C
Product Categories: C10; Carbonyl Compounds; Ketones
Canonical SMILES: CCC(=O)C1=CC=CC=C1C(F)(F)F
InChI: InChI=1S/C10H9F3O/c1-2-9(14)7-5-3-4-6-8(7)10(11,12)13/h3-6H,2H2,1H3
InChIKey: PUSBIOFSWWHNDD-UHFFFAOYSA-N

Safety Information of 2'-(Trifluoromethyl)propiophenone (CAS NO.16185-96-9):
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
HazardClass: IRRITANT

 2'-(Trifluoromethyl)propiophenone (CAS NO.16185-96-9), its Synonyms are 2-(Trifluoromethyl)propiophenone ; 1-[2-(Trifluoromethyl)phenyl]-1-propanone ; o-Trifluoromethylpropiophenone ; 1-(2-(Trifluoromethoxy)phenyl)propan-1-one .