1H-Pyrrole-2-carboxylic acid, 4-nitro-, ethyl ester


Chemical Name: 1H-Pyrrole-2-carboxylic acid, 4-nitro-, ethyl ester
CAS Number: 5930-92-7
Product Number: AG00E9OJ(AGN-PC-0JOGJM)
Synonyms:
MDL No:
Molecular Formula: C7H8N2O4
Molecular Weight: 184.1494

Identification/Properties


Properties
MP:
174 °C
BP:
347.7 °C at 760 mmHg
Storage:
2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
184.151g/mol
XLogP3:
1.1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
3
Exact Mass:
184.048g/mol
Monoisotopic Mass:
184.048g/mol
Topological Polar Surface Area:
87.9A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
213
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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