Boronic acid,B-(3-bromo-2,6-difluorophenyl)- (352535-84-3)

The 3-Bromo-2,6-difluorophenylboronic acid with the cas number 352535-84-3, is also called Boronicacid, (3-bromo-2,6-difluorophenyl)- (9CI) and 3-Bromo-2,6-Difluorophenylboro.3-Bromo-2,6-difluorophenylboronic acid belongs to the following product categories: (1)blocks; (2)BoronicAcids; (3)Bromides; (4)FluoroCompounds; (5)Aryl; (6)Organoborons; (7)Boronic Acids; (8)Boronic Acids and Derivatives; (9)Boronic Acids.

Properties of 3-Bromo-2,6-difluorophenylboronic acid : (1)ACD/LogP:  2.35; (2)# of Rule of 5 Violations:  0 ; (3)ACD/LogD (pH 5.5):  2.34  ; (4)ACD/LogD (pH 7.4):  1.9; (5)ACD/BCF (pH 5.5):  35.15; (6)ACD/BCF (pH 7.4):  12.84; (7)ACD/KOC (pH 5.5):  442.03; (8)ACD/KOC (pH 7.4):  161.48; (9)#H bond acceptors:  2; (10)#H bond donors:  2; (11)#Freely Rotating Bonds:  3; (12)Polar Surface Area:  18.46 Å²; (13)Index of Refraction:  1.547; (14)Molar Refractivity:  41.23 cm³; (15)Molar Volume:  129.8 cm³; (16)Polarizability:  16.34×10^-24cm³; (17)Surface Tension:  45.6 dyne/cm; (18)Enthalpy of Vaporization:  58.48 kJ/mol; (19)Vapour Pressure:  0.00022 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Fc1c(B(O)O)c(F)ccc1Br;
(2)InChI: InChI=1/C6H4BBrF2O2/c8-3-1-2-4(9)5(6(3)10)7(11)12/h1-2,11-12H;
(3)InChIKey: IOPHTXLBAFNMMI-UHFFFAOYAB;
(4)Std. InChI: InChI=1S/C6H4BBrF2O2/c8-3-1-2-4(9)5(6(3)10)7(11)12/h1-2,11-12H;
(5)Std. InChIKey: IOPHTXLBAFNMMI-UHFFFAOYSA-N.