Ethyl 5-nitro-1H-imidazole-4-carboxylate

CAS Registry Number®

74478-95-8
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CAS Name

Ethyl 5-nitro-1H-imidazole-4-carboxylate

Molecular Formula

C6H7N3O4

Molecular Mass

185.14

Cite this Page

Ethyl 5-nitro-1H-imidazole-4-carboxylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=74478-95-8 (retrieved 2024-08-06) (CAS RN: 74478-95-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    207-208 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C6H7N3O4/c1-2-13-6(10)4-5(9(11)12)8-3-7-4/h3H,2H2,1H3,(H,7,8)

InChIKey

InChIKey=JFHZQABGMJXACV-UHFFFAOYSA-N

SMILES

C(OCC)(=O)C1=C(N(=O)=O)N=CN1

Canonical SMILES

O=C(OCC)C=1NC=NC1N(=O)=O

Other Names for this Substance

  • 1H-Imidazole-4-carboxylic acid, 5-nitro-, ethyl ester
  • Imidazole-4-carboxylic acid, 5-nitro-, ethyl ester
  • Ethyl 5-nitro-1H-imidazole-4-carboxylate
  • NSC 98658