4-(Trifluoromethoxy)benzyl chloride

The systematic name of 4-(Trifluoromethoxy)benzyl chloride is 1-(chloromethyl)-4-(trifluoromethoxy)benzene. With the CAS registry number 65796-00-1, it is also named as alpha-chloro-4-(trifluoromethoxy)toluene. The product's categories are Trifluoroanisole Series. It is colorless to light yellow liquid which should be stored in the refrigerator. The molecular formula is C₈H₆ClF₃O and molecular weight is 210.58.

The other characteristics of 4-(Trifluoromethoxy)benzyl chloride can be summarized as: (1)ACD/LogP: 3.44; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.44; (4)ACD/LogD (pH 7.4): 3.44; (5)ACD/BCF (pH 5.5): 241.33; (6)ACD/BCF (pH 7.4): 241.33; (7)ACD/KOC (pH 5.5): 1766.34; (8)ACD/KOC (pH 7.4): 1766.34; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 9.23 Å²; (13)Index of Refraction: 1.46; (14)Molar Refractivity: 43.15 cm³; (15)Molar Volume: 157.5 cm³; (16)Polarizability: 17.1×10^-24 cm³; (17)Surface Tension: 28.1 dyne/cm; (18)Density: 1.336 g/cm³; (19)Flash Point: 68.6 °C; (20)Enthalpy of Vaporization: 40.86 kJ/mol; (21)Boiling Point: 189.8 °C at 760 mmHg; (22)Vapour Pressure: 0.774 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
It can cause burns. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. If you want to contact this product, you must wear suitable protective clothing, gloves and eye/face protection. In case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.)

People can use the following data to convert to the molecule structure.
1. SMILES:FC(F)(F)Oc1ccc(cc1)CCl
2. InChI:InChI=1/C8H6ClF3O/c9-5-6-1-3-7(4-2-6)13-8(10,11)12/h1-4H,5H2 
3. InChIKey:LBMKFQMJURUPKC-UHFFFAOYAN
4. Std. InChI:InChI=1S/C8H6ClF3O/c9-5-6-1-3-7(4-2-6)13-8(10,11)12/h1-4H,5H2 
5. Std. InChIKey:LBMKFQMJURUPKC-UHFFFAOYSA-N