1H-Indazole-5-carboxylicacid, 3-iodo-, methyl ester


Chemical Name: 1H-Indazole-5-carboxylicacid, 3-iodo-, methyl ester
CAS Number: 885271-25-0
Product Number: AG00473O(AGN-PC-0VM4OT)
Synonyms:
MDL No:
Molecular Formula: C9H7IN2O2
Molecular Weight: 302.0686

Identification/Properties


Properties
BP:
421.4°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
302.071g/mol
XLogP3:
2.1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
301.955g/mol
Monoisotopic Mass:
301.955g/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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