B(C1=CC(=CC=C1)OCC2=CC=CC=C2)(O)O
CAS: 156682-54-1
Name: (3-phenylmethoxyphenyl)boronic acid
SMILES: B(C1=CC(=CC=C1)OCC2=CC=CC=C2)(O)O

Molecular Processing

Molecular formula
C13H13BO3
Molecular weight
228.06
Exact mass
228.0958
XLogP
0.95
TPSA
49.69
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
17
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.077
Molar refractivity
67.04

Supplementary Information

InChIKey: WIJNYNBSPQMJGO-UHFFFAOYSA-N
Synonyme
3-Benzyloxyphenylboronic acid3-Benzyloxy-phenylboronic acidRefChem:498059674-523-3156682-54-13-Benzyloxybenzeneboronic Acid(3-(Benzyloxy)phenyl)boronic acid3-(Benzyloxy)phenylboronic acidMFCD02093063(3-phenylmethoxyphenyl)boronic Acid[3-(benzyloxy)phenyl]boronic acidM-BENZYLOXYPHENYLBORONIC ACIDBoronic acid, B-[3-(phenylmethoxy)phenyl]-(3-benzyloxyphenyl)boronic acidBoronic acid, [3-(phenylmethoxy)phenyl]-SCHEMBL223153-Benzyloxyphenyl Boronic Acid3-benzyloxy-benzeneboronic acid3-benzyloxybenzene boronic acid3-benzyloxy-phenyl boronic acid3-(Benzyloxy)benzeneboronic acid3-(benzyloxy)phenyl boronic acidDTXSID903702043-Benzyloxyphenylboronic acid, 97%SBB063892AKOS004116107AB10742AS-2469CS-W014695NCGC00249493-01
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