Chem
J-GLOBAL ID:200907050558972871   Nikkaji number:J86.868J

5-Methyl-2-nitro-1H-imidazole-1-propanoic acid methyl ester

5-メチル-2-ニトロ-1H-イミダゾール-1-プロパン酸メチル
Substance type:
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula: C8H11N2[N+]O3[O-]
Molecular formula furigana: C8-H11-N3-O4
Molecular weight: 213.193
InChI: InChI=1S/C8H11N3O4/c1-6-5-9-8(11(13)14)10(6)4-3-7(12)15-2/h5H,3-4H2,1-2H3
InChI key: OHPYAGLSAFEXMJ-UHFFFAOYSA-N
SMILES: COC(=O)CCn1c(C)cnc1[N+](=O)[O-]
Systematic name  (3):
  • 5-メチル-2-ニトロ-1H-イミダゾール-1-プロパン酸メチル
  • メチル 3-(5-メチル-2-ニトロ-1H-イミダゾール-1-イル)プロパノアート
  • methyl 3-(5-methyl-2-nitro-1H-imidazol-1-yl)propanoate
Other name (1):
  • 5-Methyl-2-nitro-1H-imidazole-1-propanoic acid methyl ester
CAS registry number: 64038-63-7
Regulation number (1):
  • NI8350000
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