The 4-Bromo-2-(trifluoromethyl)phenyl isocyanate has CAS registry number 41513-02-4. Its molecular formula is C₈H₃BrF₃NO and molecular weight is 266.01. What's more, its systematic name is 4-Bromo-1-isocyanato-2-(trifluoromethyl)benzene.

Physical properties about the 4-Bromo-2-(trifluoromethyl)phenyl isocyanate are: (1)ACD/LogP: 4.26; (2)# of Rule of 5 Violations: 0 ; (3)#H bond acceptors: 2; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 1; (6)Polar Surface Area: 29.43 Å²; (7)Index of Refraction: 1.512; (8)Molar Refractivity: 48.46 cm³; (9)Molar Volume: 161.4 cm³; (10)Surface Tension: 34.9 dyne/cm; (11)Density: 1.64 g/cm³; (12)Flash Point: 96.3 °C; (13)Enthalpy of Vaporization: 47.23 kJ/mol; (14)Boiling Point: 235.6 °C at 760 mmHg; (15)Vapour Pressure: 0.0497 mmHg at 25 °C.

When you are using this chemical, please be cautious about it as the following:
As a chemical, it is irritating to eyes, respiratory system and skin. If contact with eyes accidently, rinse immediately with plenty of water and seek medical advice. In addition, during using it, wear suitable protective clothing.

You can still convert the following datas into molecular structure:
(1) SMILES: Brc1cc(c(\N=C=O)cc1)C(F)(F)F
(2) InChI: InChI=1/C8H3BrF3NO/c9-5-1-2-7(13-4-14)6(3-5)8(10,11)12/h1-3H
(3) InChIKey: UZFHKVBCBXPKKE-UHFFFAOYAJ