Benzoic acid, 2-bromo-5-fluoro-


Chemical Name: Benzoic acid, 2-bromo-5-fluoro-
CAS Number: 394-28-5
Product Number: AG00335M(AGN-PC-01412X)
Synonyms:
MDL No:
Molecular Formula: C7H4BrFO2
Molecular Weight: 219.0079

Identification/Properties


Properties
MP:
154-157 °C(lit.)
BP:
291.1°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
219.009g/mol
XLogP3:
3.1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
217.938g/mol
Monoisotopic Mass:
217.938g/mol
Topological Polar Surface Area:
37.3A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
163
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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