Boronic acid,B-[4-fluoro-2-(trifluoromethyl)phenyl]- supplier

Name
4-FLUORO-2-(TRIFLUOROMETHYL)BENZENEBORONIC ACID
EINECS
CAS No. 182344-16-7
Density 1.443 g/cm³
Solubility
Melting Point 183-186°C
Formula C₇H₅BF₄O₂
Boiling Point 259.584 °C at 760 mmHg
Molecular Weight 207.92
Flash Point 110.793 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms AKOS BRN-1027;4-Fluoro-2-(trifluoromethyl)phenylboronic acid;4-Fluoro-2-(trifluoromethyl)benzeneboronic acid;
PSA 40.46000
LogP 0.52430

Boronic acid,B-[4-fluoro-2-(trifluoromethyl)phenyl]- Specification

The Boronic acid,B-[4-fluoro-2-(trifluoromethyl)phenyl]-, with the CAS registry number 182344-16-7, is also known as 4-Fluoro-2-(trifluoromethyl)phenylboronic acid. It belongs to the product categories of Miscellaneous; Aryl; Organoborons. This chemical's molecular formula is C₇H₅BF₄O₂and molecular weight is 207.92. What's more, its systematic name is 4-Fluoro-2-(trifluoromethyl)benzeneboronic acid. It should be sealed and stored in in cool, ventilated and dry places and be protected from oxidizers.

Physical properties of Boronic acid,B-[4-fluoro-2-(trifluoromethyl)phenyl]- are: (1)ACD/LogP: 2.09; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2; (4)ACD/LogD (pH 7.4): 2; (5)ACD/BCF (pH 5.5): 21; (6)ACD/BCF (pH 7.4): 19; (7)ACD/KOC (pH 5.5): 311; (8)ACD/KOC (pH 7.4): 273; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 40.46 Å²; (13)Index of Refraction: 1.446; (14)Molar Refractivity: 38.391 cm³; (15)Molar Volume: 144.089 cm³; (16)Polarizability: 15.219×10^-24cm³; (17)Surface Tension: 31.386 dyne/cm; (18)Density: 1.443 g/cm³; (19)Flash Point: 110.793 °C; (20)Enthalpy of Vaporization: 52.534 kJ/mol; (21)Boiling Point: 259.584 °C at 760 mmHg; (22)Vapour Pressure: 0.007 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: OB(O)c1ccc(F)cc1C(F)(F)F
(2)InChI: InChI=1S/C7H5BF4O2/c9-4-1-2-6(8(13)14)5(3-4)7(10,11)12/h1-3,13-14H
(3)InChIKey: SWUPLEAGZOKLNX-UHFFFAOYSA-N

Product Name

4-FLUORO-2-(TRIFLUOROMETHYL)BENZENEBORONIC ACID

Boronic acid,B-[4-fluoro-2-(trifluoromethyl)phenyl]- Specification

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