2-bromo-6-fluoro-4-methoxyphenylboronic acid

2-bromo-6-fluoro-4-methoxyphenylboronic acid

CAS: 1315476-03-9

Formula: C7H7BBrFO3

SMILES: COC1=CC(Br)=C(B(O)O)C(F)=C1

IUPAC: (2-bromo-6-fluoro-4-methoxyphenyl)boronic acid

InChI: InChI=1S/C7H7BBrFO3/c1-13-4-2-5(9)7(8(11)12)6(10)3-4/h2-3,11-12H,1H3

Composition: C (33.79%), H (2.84%), B (4.34%), Br (32.11%), F (7.63%), O (19.29%)

Molar Mass: 248.84

Atom Count: 20

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	247.965565
Formal Charge	0
FSP3	0.14
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	NORQOWBPWLGVLB-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	44.91
Topological Polar Surface Area	49.69
Polarizability	18.81
Ring Count	1
Rotatable Bond Count	2

Suppliers

MATRIX SCIENTIFIC

Supplier Profile

Purity	LeadTime	CAS		UnitPrice
95%	<2 Days	1315476-03-9		Quote Only