Boronic acid, [(1E)-2-[4-(trifluoromethyl)phenyl]ethenyl]-


Chemical Name: Boronic acid, [(1E)-2-[4-(trifluoromethyl)phenyl]ethenyl]-
CAS Number: 352525-91-8
Product Number: AG00C0YH(AGN-PC-0O9891)
Synonyms:
MDL No:
Molecular Formula: C9H8BF3O2
Molecular Weight: 215.9648

Identification/Properties


Properties
MP:
204-210°C(lit.);
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
215.966g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
2
Exact Mass:
216.057g/mol
Monoisotopic Mass:
216.057g/mol
Topological Polar Surface Area:
40.5A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
220
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
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+P312-P305+P351+P338-P332+P313-P337+P313-P362-P403+P233-P405-P501
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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