(4-cyano-2-fluorophenyl)boronic acid


Chemical Name: (4-cyano-2-fluorophenyl)boronic acid
CAS Number: 1150114-77-4
Product Number: AG000FN2(AGN-PC-078JTX)
Synonyms:
MDL No: MFCD07644472
Molecular Formula: C7H5BFNO2
Molecular Weight: 164.9295

Identification/Properties


Computed Properties
Molecular Weight:
164.93g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
165.04g/mol
Monoisotopic Mass:
165.04g/mol
Topological Polar Surface Area:
64.2A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
203
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-H319
Precautionary Statements:
P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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