3-borono-5-fluorobenzoic acid


Chemical Name: 3-borono-5-fluorobenzoic acid
CAS Number: 871329-84-9
Product Number: AG004OT6(AGN-PC-0786CG)
Synonyms:
MDL No: MFCD07363791
Molecular Formula: C7H6BFO4
Molecular Weight: 183.9295

Identification/Properties


Properties
MP:
264-266℃
Storage:
2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
183.929g/mol
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
2
Exact Mass:
184.034g/mol
Monoisotopic Mass:
184.034g/mol
Topological Polar Surface Area:
77.8A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
199
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-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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