2-Bromo-5-(trifluoromethyl)benzoic acid supplier

Name
2-BROMO-5-(TRIFLUOROMETHYL)BENZOIC ACID
EINECS
CAS No. 1483-56-3
Article Data7
CAS DataBase
Density 1.774 g/cm³
Solubility Slightly soluble in water.
Melting Point 116-117℃
Formula C₈H₄BrF₃O₂
Boiling Point 301.048 °C at 760 mmHg
Molecular Weight 269.018
Flash Point 135.869 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 6-Bromo-α,α,α-trifluoro-m-toluic acid;m-Toluicacid, 6-bromo-a,a,a-trifluoro- (7CI,8CI);
PSA 37.30000
LogP 3.16610

2-Bromo-5-(trifluoromethyl)benzoic acid Specification

The Benzoic acid,2-bromo-5-(trifluoromethyl)- is an organic compound with the formula C₈H₄BrF₃O₂. The systematic name of this chemical is 2-Bromo-5-(trifluoromethyl)benzoic acid. With the CAS registry number 1483-56-3, it is also named as 6-Bromo-α,α,α-trifluoro-m-toluic acid. Besides, its molecular weight is 269.0154.

Physical properties about Benzoic acid,2-bromo-5-(trifluoromethyl)- are: (1)ACD/LogP: 2.95; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 1.49; (5)ACD/KOC (pH 7.4): 1; (6)#H bond acceptors: 2; (7)#H bond donors: 1; (8)#Freely Rotating Bonds: 1; (9)Polar Surface Area: 37.3 Å²; (10)Index of Refraction: 1.516; (11)Molar Refractivity: 45.85 cm³; (12)Molar Volume: 151.6 cm³; (13)Polarizability: 18.17×10^-24 cm³; (14)Surface Tension: 38.2 dyne/cm; (15)Density: 1.773 g/cm³; (16)Flash Point: 135.9 °C; (17)Enthalpy of Vaporization: 57.15 kJ/mol; (18)Boiling Point: 301 °C at 760 mmHg; (19)Vapour Pressure: 0.000479 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)InChI: InChI=1/C8H4BrF3O2/c9-6-2-1-4(8(10,11)12)3-5(6)7(13)14/h1-3H,(H,13,14)
(2)InChIKey: REBQGRPKXYIJDC-UHFFFAOYAY
(3)Std. InChI: InChI=1S/C8H4BrF3O2/c9-6-2-1-4(8(10,11)12)3-5(6)7(13)14/h1-3H,(H,13,14)
(4)Std. InChIKey: REBQGRPKXYIJDC-UHFFFAOYSA-N

Product Name

2-BROMO-5-(TRIFLUOROMETHYL)BENZOIC ACID

2-Bromo-5-(trifluoromethyl)benzoic acid Specification

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