Benzoic acid, 5-bromo-2-methoxy-


Chemical Name: Benzoic acid, 5-bromo-2-methoxy-
CAS Number: 2476-35-9
Product Number: AG002PCZ(AGN-PC-0JXIDV)
Synonyms:
MDL No:
Molecular Formula: C8H7BrO3
Molecular Weight: 231.0434

Identification/Properties


Properties
MP:
118-122 °C
BP:
334.7°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
231.045g/mol
XLogP3:
3
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
229.958g/mol
Monoisotopic Mass:
229.958g/mol
Topological Polar Surface Area:
46.5A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
172
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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