4-Bromo-2-fluoro-5-(trifluoromethyl)aniline supplier

Name
4-BROMO-2-FLUORO-5-(TRIFLUOROMETHYL)ANILINE
EINECS
CAS No. 104460-70-0
Article Data2
CAS DataBase
Density 1.771g/cm³
Solubility
Melting Point 35-37 °C
Formula C₇H₄BrF₄N
Boiling Point 209.1 °C at 760 mmHg
Molecular Weight 258.013
Flash Point 80.3 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 4-Bromo-2-fluoro-5-(trifluoromethyl)aniline;
PSA 26.02000
LogP 3.77040

4-Bromo-2-fluoro-5-(trifluoromethyl)aniline Specification

The 4-Bromo-2-fluoro-5-(trifluoromethyl)aniline is an organic compound with the formula C₇H₄BrF₄N. The IUPAC name of this chemical is 4-bromo-2-fluoro-5-(trifluoromethyl)aniline. With the CAS registry number 104460-70-0, it is also named as Benzenamine, 4-bromo-2-fluoro-5-(trifluoromethyl)-. The product's categories are Anilines, Aromatic Amines and Nitro Compounds.

Physical properties about 4-Bromo-2-fluoro-5-(trifluoromethyl)aniline are: (1)ACD/LogP: 3.83; (2)ACD/LogD (pH 5.5): 3.83; (3)ACD/LogD (pH 7.4): 3.83; (4)ACD/BCF (pH 5.5): 480.42; (5)ACD/BCF (pH 7.4): 480.45; (6)ACD/KOC (pH 5.5): 2891.34; (7)ACD/KOC (pH 7.4): 2891.51; (8)#H bond acceptors: 1; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 1; (11)Polar Surface Area: 3.24 Å²; (12)Index of Refraction: 1.504; (13)Molar Refractivity: 43.15 cm³; (14)Molar Volume: 145.6 cm³; (15)Polarizability: 17.1×10^-24cm³; (16)Surface Tension: 32.5 dyne/cm; (17)Density: 1.771 g/cm³; (18)Flash Point: 80.3 °C; (19)Enthalpy of Vaporization: 44.54 kJ/mol; (20)Boiling Point: 209.1 °C at 760 mmHg; (21)Vapour Pressure: 0.206 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: FC(F)(F)c1cc(c(F)cc1Br)N
(2)InChI: InChI=1/C7H4BrF4N/c8-4-2-5(9)6(13)1-3(4)7(10,11)12/h1-2H,13H2
(3)InChIKey: UYVDMCXPDGRLEC-UHFFFAOYAC
(4)Std. InChI: InChI=1S/C7H4BrF4N/c8-4-2-5(9)6(13)1-3(4)7(10,11)12/h1-2H,13H2
(5)Std. InChIKey: UYVDMCXPDGRLEC-UHFFFAOYSA-N

Product Name

4-BROMO-2-FLUORO-5-(TRIFLUOROMETHYL)ANILINE

4-Bromo-2-fluoro-5-(trifluoromethyl)aniline Specification

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