3-Carboxy-2-fluorophenylboronic acid, pinacol ester


Chemical Name: 3-Carboxy-2-fluorophenylboronic acid, pinacol ester
CAS Number: 1373168-89-8
Product Number: AG00132X(AGN-PC-0WA8DF)
Synonyms:
MDL No:
Molecular Formula: C13H16BFO4
Molecular Weight: 266.0731

Identification/Properties


Computed Properties
Molecular Weight:
266.075g/mol
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
2
Exact Mass:
266.113g/mol
Monoisotopic Mass:
266.113g/mol
Topological Polar Surface Area:
55.8A^2
Heavy Atom Count:
19
Formal Charge:
0
Complexity:
356
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-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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