Methyl 3-Bromo-5-fluoro-4-methylbenzoate


Chemical Name: Methyl 3-Bromo-5-fluoro-4-methylbenzoate
CAS Number: 1533932-57-8
Product Number: AG00HY4L(AGN-PC-0WAH38)
Synonyms:
MDL No:
Molecular Formula: C9H8BrFO2
Molecular Weight: 247.0610

Identification/Properties


Computed Properties
Molecular Weight:
247.063g/mol
XLogP3:
2.9
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
245.969g/mol
Monoisotopic Mass:
245.969g/mol
Topological Polar Surface Area:
26.3A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
198
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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