3-Methoxy-5-(trifluoromethoxy)phenylboronic acid


Chemical Name: 3-Methoxy-5-(trifluoromethoxy)phenylboronic acid
CAS Number: 1256345-88-6
Product Number: AG000O0R(AGN-PC-0WA8SE)
Synonyms:
MDL No:
Molecular Formula: C8H8BF3O4
Molecular Weight: 235.9529

Identification/Properties


Computed Properties
Molecular Weight:
235.953g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
7
Rotatable Bond Count:
3
Exact Mass:
236.047g/mol
Monoisotopic Mass:
236.047g/mol
Topological Polar Surface Area:
58.9A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
224
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:
P261-P280-P305+P351+P338-P304+P340-P405
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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