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Structure

1H-Imidazole-4-carboxylicacid,5-nitro-,methyl ester

CAS
20271-20-9
Catalog Number
ACM20271209
Category
Other Products
Molecular Weight
171.1109
Molecular Formula
C5H5N3O4

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Specification

Synonyms
MLS002639128, NSC26494, ZERO/008398, MolPort-005-306-339, CID177122, ZINC04344034, 5-Imidazolic acid, 4-nitro-, methyl ester, SMR001548579, Imidazole-4-carboxylic acid, 5-nitro-, methyl ester, 20271-20-9
IUPAC Name
methyl 4-nitro-1H-imidazole-5-carboxylate
Canonical SMILES
COC(=O)C1=C(N=CN1)[N+](=O)[O-]
InChI Key
YGTWILAKCGDEML-UHFFFAOYSA-N
Boiling Point
409.7ºC at 760mmHg
Flash Point
201.6ºC
Density
1.545g/cm³
Exact Mass
171.02800
H-Bond Acceptor
5
H-Bond Donor
1
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