Boronic acid, B-[2-methyl-4-(trifluoromethyl)phenyl]-


Chemical Name: Boronic acid, B-[2-methyl-4-(trifluoromethyl)phenyl]-
CAS Number: 957034-45-6
Product Number: AG005Z07(AGN-PC-078TDK)
Synonyms:
MDL No:
Molecular Formula: C8H8BF3O2
Molecular Weight: 203.9541

Identification/Properties


Properties
BP:
271.9°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
203.955g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
1
Exact Mass:
204.057g/mol
Monoisotopic Mass:
204.057g/mol
Topological Polar Surface Area:
40.5A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
196
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


NMR Spectrum


Other Analytical Data


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