2-bromo-5-chloro-4-fluorophenylboronic acid

2-bromo-5-chloro-4-fluorophenylboronic acid

Formula: C6H4BBrClFO2

SMILES: OB(O)C1=CC(Cl)=C(F)C=C1Br

IUPAC: (2-bromo-5-chloro-4-fluorophenyl)boronic acid

InChI: InChI=1S/C6H4BBrClFO2/c8-4-2-6(10)5(9)1-3(4)7(11)12/h1-2,11-12H

Composition: C (28.46%), H (1.59%), B (4.27%), Br (31.55%), Cl (14.00%), F (7.50%), O (12.63%)

Molar Mass: 253.26

Atom Count: 16

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	251.916028
Formal Charge	0
FSP3	0
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
InChIKey	WVCQAMXZHGGJST-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	43.25
Topological Polar Surface Area	40.46
Polarizability	18.27
Ring Count	1
Rotatable Bond Count	1

Suppliers

Key Organics Ltd

Supplier Profile

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<2 Days	C6H4BBrClFO2		$51.35-$86.31$51.35$63.37$86.31