6-Bromo-2-fluoro-3-methylphenylboronic acid supplier

Name
6-Bromo-2-fluoro-3-methylphenylboronic acid
EINECS
CAS No. 957061-15-3
Density 1.65 g/cm³
Solubility
Melting Point
Formula C₇H₇BBrFO₂
Boiling Point 347.3 °C at 760 mmHg
Molecular Weight 232.84
Flash Point 163.8 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 6-Bromo-2-fluoro-3-methylphenylboronic acid;
PSA 40.46000
LogP 0.57640

6-Bromo-2-fluoro-3-methylphenylboronic acid Specification

The 6-Bromo-2-fluoro-3-methylphenylboronic acid with the CAS number 957061-15-3 is also called Boronic acid,B-(6-bromo-2-fluoro-3-methylphenyl)-. Its molecular formula is C₇H₇BBrFO₂. This chemical belongs to the following product categories: (1)Blocks; (2)BoronicAcids; (3)Bromides.

The properties of the 6-Bromo-2-fluoro-3-methylphenylboronic acid are: (1)ACD/LogP: 2.86; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.86; (4)ACD/LogD (pH 7.4): 2.79 ; (5)#H bond acceptors: 2; (6)#H bond donors: 2; (7)#Freely Rotating Bonds: 3; (8)Polar Surface Area: 40.46 Å²; (9)Index of Refraction: 1.562; (10)Molar Refractivity: 45.74 cm³; (11)Molar Volume: 141 cm³; (12)Polarizability: 18.13×10^-24cm³; (13)Surface Tension: 46.5 dyne/cm; (14)Enthalpy of Vaporization: 62.43 kJ/mol; (15)Vapour Pressure: 2.05×10^-5 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: B(c1c(ccc(c1F)C)Br)(O)O
(2)InChI: InChI=1/C7H7BBrFO2/c1-4-2-3-5(9)6(7(4)10)8(11)12/h2-3,11-12H,1H3
(3)InChIKey: NJHQHIZZGJAIAE-UHFFFAOYAE

Product Name

6-Bromo-2-fluoro-3-methylphenylboronic acid

6-Bromo-2-fluoro-3-methylphenylboronic acid Specification

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