1H-Indazole-3-carboxylic acid, 5-bromo-, methyl ester


Chemical Name: 1H-Indazole-3-carboxylic acid, 5-bromo-, methyl ester
CAS Number: 78155-74-5
Product Number: AG00357U(AGN-PC-0NJWQ3)
Synonyms:
MDL No: MFCD07371572
Molecular Formula: C9H7BrN2O2
Molecular Weight: 255.0681

Identification/Properties


Properties
MP:
208-210℃
BP:
399.7°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
255.071g/mol
XLogP3:
2.4
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
253.969g/mol
Monoisotopic Mass:
253.969g/mol
Topological Polar Surface Area:
55A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
237
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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