ethyl 5-nitro-1H-imidazole-2-carboxylate


Chemical Name: ethyl 5-nitro-1H-imidazole-2-carboxylate
CAS Number: 865998-46-5
Product Number: AG004U13(AGN-PC-09Q64K)
Synonyms:
MDL No:
Molecular Formula: C6H7N3O4
Molecular Weight: 185.1375

Identification/Properties


Properties
BP:
405.4°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
185.139g/mol
XLogP3:
0.8
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
3
Exact Mass:
185.044g/mol
Monoisotopic Mass:
185.044g/mol
Topological Polar Surface Area:
101A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
214
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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