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CAS Number: 865998-46-5
ethyl 4-nitro-1H-imidazole-2-carboxylate

Structure

 ethyl 4-nitro-1H-imidazole-2-carboxylate
Name: ethyl 4-nitro-1H-imidazole-2-carboxylate
Synonyms:
General Information
Product Number: 865998465

CAS Registry Number 865998-46-5
Name:
1H-?Imidazole-?2-?carboxylic acid, 5-?nitro-?, ethyl ester
1H-Imidazole-2-carboxylic acid, 4-nitro-, ethyl ester (9CI)
4-Nitro-1H-imidazole-2-carboxylic acid ethyl ester
Ethyl 4-nitro-1H-imidazole-2-carboxylate
Ethyl 5-nitro-1H-imidazole-2-carboxylate

 

Chemical Formula: C6H7N3O4
Exact Mass: 185.04
Molecular Weight: 185.14
m/z: 185.04 (100.0%), 186.05 (6.7%), 186.04 (1.1%), 187.05 (1.0%)

 

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

InChI Key:YSVPLWXCZZORIO-UHFFFAOYSA-N

Canonical SMILES:CCOC(=O)C1=NC=C(N1)[N+](=O)[O-]

Specification

98%
References

PCT Int. Appl. (2013), WO 2013037812 A1 20130321.

PCT Int. Appl. (2006), WO 2006089664 A2 20060831. 
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