4-Hydroxy-2-(trifluoromethyl)phenylboronic acid


Chemical Name: 4-Hydroxy-2-(trifluoromethyl)phenylboronic acid
CAS Number: 943918-05-6
Product Number: AG003BW0(AGN-PC-078JMJ)
Synonyms:
MDL No:
Molecular Formula: C7H6BF3O3
Molecular Weight: 205.9269

Identification/Properties


Properties
BP:
354.5°C at 760 mmHg
Storage:
Inert atmosphere;-10 ℃;
Computed Properties
Molecular Weight:
205.927g/mol
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
1
Exact Mass:
206.036g/mol
Monoisotopic Mass:
206.036g/mol
Topological Polar Surface Area:
60.7A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
197
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:
H302
Precautionary Statements:
P280-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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