3-Bromo-indazole-5-carboxylic acid


Chemical Name: 3-Bromo-indazole-5-carboxylic acid
CAS Number: 885521-49-3
Product Number: AG004D72(AGN-PC-0WA8BT)
Synonyms:
MDL No:
Molecular Formula: C8H5BrN2O2
Molecular Weight: 241.0415

Identification/Properties


Properties
MP:
>300°C
BP:
493.4±25.0°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
241.044g/mol
XLogP3:
2.1
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
239.953g/mol
Monoisotopic Mass:
239.953g/mol
Topological Polar Surface Area:
66A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
224
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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