Chem
J-GLOBAL ID：200907093109428602
Nikkaji number：J315.610I
3-Nitro-5H-1,2,4-triazol-5-one
3-ニトロ-5H-1,2,4-トリアゾール-5-オン
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
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
Molecular formula： C2N3[N+]O2[O-]
Molecular formula furigana： C2-N4-O3
Molecular weight： 128.047
InChI：
InChI=1S/C2N4O3/c7-2-3-1(4-5-2)6(8)9
InChI key：
NVKJOXRVEKMMHS-UHFFFAOYSA-N
SMILES：
[O-][N+](=O)C1=NC(=O)N=N1
Systematic name (3)：
- 3-ニトロ-5H-1,2,4-トリアゾール-5-オン
- 5-ニトロ-3H-1,2,4-トリアゾール-3-オン
- 5-nitro-3H-1,2,4-triazol-3-one
- 3-Nitro-5H-1,2,4-triazol-5-one
- 5-Nitro-3H-1,2,4-triazole-3-one
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