3-(4-bromo-2-fluorophenyl)propanoic acid


Chemical Name: 3-(4-bromo-2-fluorophenyl)propanoic acid
CAS Number: 134057-95-7
Product Number: AG009BG4(AGN-PC-003Q3L)
Synonyms:
MDL No: MFCD06823987
Molecular Formula: C9H8BrFO2
Molecular Weight: 247.0610

Identification/Properties


Computed Properties
Molecular Weight:
247.063g/mol
XLogP3:
2.5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
245.969g/mol
Monoisotopic Mass:
245.969g/mol
Topological Polar Surface Area:
37.3A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
187
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


NMR Spectrum


Other Analytical Data


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