Boronic acid, [4-(phenylmethoxy)phenyl]-


Chemical Name: Boronic acid, [4-(phenylmethoxy)phenyl]-
CAS Number: 146631-00-7
Product Number: AG007J31(AGN-PC-0KK6HP)
Synonyms:
MDL No: MFCD01075705
Molecular Formula: C13H13BO3
Molecular Weight: 228.0515

Identification/Properties


Computed Properties
Molecular Weight:
228.054g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
4
Exact Mass:
228.096g/mol
Monoisotopic Mass:
228.096g/mol
Topological Polar Surface Area:
49.7A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
209
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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