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2-(3'-Fluorobenzyloxy)phenylboronic acid

CAS
871126-24-8
Catalog Number
ACM871126248
Category
Other Products
Molecular Weight
246.04g/mol
Molecular Formula
C13H12BFO3

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Specification

Synonyms
2-(3-Fluorobenzyloxy)phenylboronic acid, 871126-24-8, 2-(3-Fluorobenzyloxy)phenylboronic acid, SureCN2558783, 657492_ALDRICH, CTK8B2518, MolPort-003-938-417, ANW-38516, AKOS009318218, AK-85629, KB-14492, X2592, (2-((3-Fluorobenzyl)oxy)phenyl)boronic acid, I01-11455, 2-(3 inverted exclamation marka-Fluorobenzyloxy)phenylboronic acid
IUPAC Name
[2-[(3-fluorophenyl)methoxy]phenyl]boronic acid
Canonical SMILES
B(C1=CC=CC=C1OCC2=CC(=CC=C2)F)(O)O
InChI
InChI=1S/C13H12BFO3/c15-11-5-3-4-10(8-11)9-18-13-7-2-1-6-12(13)14(16)17/h1-8,16-17H,9H2
InChI Key
OYOSTGWFRFFDLQ-UHFFFAOYSA-N
Boiling Point
425.5ºC at 760 mmHg
Melting Point
99-102ºC
Flash Point
211.1ºC
Density
1.26g/cm³
Complexity
252
Covalently-Bonded Unit Count
1
Exact Mass
246.086353g/mol
Formal Charge
0
H-Bond Acceptor
4
H-Bond Donor
2
Heavy Atom Count
18
Monoisotopic Mass
246.086353g/mol
Rotatable Bond Count
4
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