[4-fluoro-3-(propan-2-ylcarbamoyl)phenyl]boronic acid


Chemical Name: [4-fluoro-3-(propan-2-ylcarbamoyl)phenyl]boronic acid
CAS Number: 874219-21-3
Product Number: AG004J9Q(AGN-PC-0786JW)
Synonyms:
MDL No:
Molecular Formula: C10H13BFNO3
Molecular Weight: 225.0245

Identification/Properties


Properties
MP:
263-265 °C
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
225.026g/mol
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
3
Exact Mass:
225.097g/mol
Monoisotopic Mass:
225.097g/mol
Topological Polar Surface Area:
69.6A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
250
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:
H315-H319-H335
Precautionary Statements:
P261-P264-P271-P280-P302+P352-P304+P340+P312-P305+P351+P338-P332+P313-P337+P313-P362-P403+P233-P405-P501
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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