3-fluoro-4-(methoxymethoxy)phenylboronic acid

3-fluoro-4-(methoxymethoxy)phenylboronic acid

CAS: 143610-62-2

Formula: C8H10BFO4

SMILES: COCOC1=C(F)C=C(C=C1)B(O)O

IUPAC: [3-fluoro-4-(methoxymethoxy)phenyl]boronic acid

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

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	2
InChIKey	WTUNKAOADNKCOF-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	43.14
Topological Polar Surface Area	58.92
Polarizability	18.35
Ring Count	1
Rotatable Bond Count	4

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