Boronic acid,B-[3-[[4-(trifluoromethoxy)phenoxy]methyl]phenyl]-


Chemical Name: Boronic acid,B-[3-[[4-(trifluoromethoxy)phenoxy]methyl]phenyl]-
CAS Number: 849062-06-2
Product Number: AG003HYX(AGN-PC-0UV8E5)
Synonyms:
MDL No:
Molecular Formula: C14H12BF3O4
Molecular Weight: 312.0489

Identification/Properties


Properties
MP:
118-127℃
Storage:
Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
312.051g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
7
Rotatable Bond Count:
5
Exact Mass:
312.078g/mol
Monoisotopic Mass:
312.078g/mol
Topological Polar Surface Area:
58.9A^2
Heavy Atom Count:
22
Formal Charge:
0
Complexity:
333
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#:
-
Hazard Statements:
H315-H319-H335-H413
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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