2-amino-5-bromo-4-methoxybenzoic acid


Chemical Name: 2-amino-5-bromo-4-methoxybenzoic acid
CAS Number: 169045-04-9
Product Number: AG001YG4(AGN-PC-02IP7A)
Synonyms:
MDL No:
Molecular Formula: C8H8BrNO3
Molecular Weight: 246.0580

Identification/Properties


Properties
MP:
201°C
BP:
363.6±42.0°C at 760 mmHg
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
246.06g/mol
XLogP3:
2
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
2
Exact Mass:
244.969g/mol
Monoisotopic Mass:
244.969g/mol
Topological Polar Surface Area:
72.6A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
200
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


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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