2-fluoro-4-(hydroxymethyl)-5-methoxyphenylboronic acid

2-fluoro-4-(hydroxymethyl)-5-methoxyphenylboronic acid

Formula: C8H10BFO4

SMILES: COC1=C(CO)C=C(F)C(=C1)B(O)O

IUPAC: [2-fluoro-4-(hydroxymethyl)-5-methoxyphenyl]boronic acid

InChI: InChI=1S/C8H10BFO4/c1-14-8-3-6(9(12)13)7(10)2-5(8)4-11/h2-3,11-13H,4H2,1H3

Composition: C (48.05%), H (5.04%), B (5.41%), F (9.50%), O (32.00%)

Molar Mass: 199.97

Atom Count: 24

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	200.065617
Formal Charge	0
FSP3	0.25
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	3
InChIKey	DMPCRVUYTKFLDE-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	44.1
Topological Polar Surface Area	69.92
Polarizability	18.28
Ring Count	1
Rotatable Bond Count	3

Suppliers

Molecule Market Select

Purity	LeadTime	Formula		UnitPrice
98%	<10 Days	C8H10BFO4		Quote Only