2-(2,2,2-Trifluoroethoxy)phenylboronic acid


Chemical Name: 2-(2,2,2-Trifluoroethoxy)phenylboronic acid
CAS Number: 957060-90-1
Product Number: AG00H840(AGN-PC-06GMHI)
Synonyms:
MDL No:
Molecular Formula: C8H8BF3O3
Molecular Weight: 219.9535

Identification/Properties


Properties
MP:
125-128℃
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
219.954g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
3
Exact Mass:
220.052g/mol
Monoisotopic Mass:
220.052g/mol
Topological Polar Surface Area:
49.7A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
198
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
Precautionary Statements:
P261-P264-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P332+P313-P337+P313-P362-P403+P233-P405-P501
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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