Boronic acid, [3-chloro-4-(trifluoromethyl)phenyl]-


Chemical Name: Boronic acid, [3-chloro-4-(trifluoromethyl)phenyl]-
CAS Number: 847756-88-1
Product Number: AG0039KD(AGN-PC-0KZUUP)
Synonyms:
MDL No: MFCD03788417
Molecular Formula: C7H5BClF3O2
Molecular Weight: 224.3726

Identification/Properties


Computed Properties
Molecular Weight:
224.37g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
1
Exact Mass:
224.002g/mol
Monoisotopic Mass:
224.002g/mol
Topological Polar Surface Area:
40.5A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
200
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-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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