Methyl 4-bromo-2,5-difluorobenzoate


Chemical Name: Methyl 4-bromo-2,5-difluorobenzoate
CAS Number: 1193162-21-8
Product Number: AG000IL6(AGN-PC-0WAMX6)
Synonyms:
MDL No: MFCD23713110
Molecular Formula: C8H5BrF2O2
Molecular Weight: 251.0249

Identification/Properties


Computed Properties
Molecular Weight:
251.027g/mol
XLogP3:
2.7
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
2
Exact Mass:
249.944g/mol
Monoisotopic Mass:
249.944g/mol
Topological Polar Surface Area:
26.3A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
201
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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