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


Chemical Name: Boronic acid, [4-chloro-3-(trifluoromethoxy)phenyl]-
CAS Number: 902757-07-7
Product Number: AG00IG2B(AGN-PC-0HEMGM)
Synonyms:
MDL No:
Molecular Formula: C7H5BClF3O3
Molecular Weight: 240.3720

Identification/Properties


Computed Properties
Molecular Weight:
240.369g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
2
Exact Mass:
239.997g/mol
Monoisotopic Mass:
239.997g/mol
Topological Polar Surface Area:
49.7A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
214
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#:
N/A
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P280-P301+P312-P302+P352-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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