Benzoic acid,4-borono-2-bromo-5-fluoro-


Chemical Name: Benzoic acid,4-borono-2-bromo-5-fluoro-
CAS Number: 957034-89-8
Product Number: AG00IJD5(AGN-PC-0W5C3W)
Synonyms:
MDL No:
Molecular Formula: C7H5BBrFO4
Molecular Weight: 262.8256

Identification/Properties


Computed Properties
Molecular Weight:
262.825g/mol
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
2
Exact Mass:
261.945g/mol
Monoisotopic Mass:
261.945g/mol
Topological Polar Surface Area:
77.8A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
228
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:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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