3-BROMO-5-(TRIFLUOROMETHYL)BENZALDEHYDE

The CAS register number of 3-Bromo-5-(trifluoromethyl)benzaldehyde is 477535-41-4. It also can be called as 3-Bromo-5-(trifluoromethyl)benzaldehyde97%. The molecular formula about this chemical is C₈H₄BrF₃O and the molecular weight is 253.02. It belongs to the following product categories which include Aldehydes; blocks; Bromides; Aromatic Aldehydes & Derivatives (substituted) and so on. This chemical is irritant. It may cause inflammation to the skin or other mucous membranes. If you want to store it, you should keep the container tightly sealed in dry, cool places and avoid contact with oxide. If you store and use this chemical according the rule, it will not be decomposed.

Physical properties about 3-Bromo-5-(trifluoromethyl)benzaldehyde are: (1)ACD/LogP: 3.04; (2)ACD/LogD (pH 5.5): 3.04; (3)ACD/LogD (pH 7.4): 3.04; (4)ACD/BCF (pH 5.5): 119.45; (5)ACD/BCF (pH 7.4): 119.45; (6)ACD/KOC (pH 5.5): 1067.73; (7)ACD/KOC (pH 7.4): 1067.73; (8)#H bond acceptors: 1; (9)#Freely Rotating Bonds: 1; (10)Polar Surface Area: 17.07 Å²; (11)Index of Refraction: 1.517; (12)Molar Refractivity: 45.67 cm³; (13)Molar Volume: 150.7 cm³; (14)Polarizability: 18.1x10^-24cm³; (15)Surface Tension: 32.4 dyne/cm; (16)Density: 1.677 g/cm³; (17)Flash Point: 86.2 °C; (18)Enthalpy of Vaporization: 45.53 kJ/mol; (19)Boiling Point: 218.9 °C at 760 mmHg; (20)Vapour Pressure: 0.123 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)SMILES: FC(F)(F)c1cc(cc(Br)c1)C=O
(2)InChI: InChI=1/C8H4BrF3O/c9-7-2-5(4-13)1-6(3-7)8(10,11)12/h1-4H
(3)InChIKey: PCRLZGCXLNNMFL-UHFFFAOYAB
(4)Std. InChI: InChI=1S/C8H4BrF3O/c9-7-2-5(4-13)1-6(3-7)8(10,11)12/h1-4H
(5)Std. InChIKey: PCRLZGCXLNNMFL-UHFFFAOYSA-N