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Home >> Chemical Listing >> Page 1982 >> 4-(3-Nitro-1H-1,2,4-Triazol-1-Yl)-2-Butanone

4-(3-Nitro-1H-1,2,4-Triazol-1-Yl)-2-Butanone
[CAS# 60728-92-9]

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Identification
Name 4-(3-Nitro-1H-1,2,4-Triazol-1-Yl)-2-Butanone
Synonyms 4-(3-nitro-1H-1,2,4-triazol-1-yl)butan-2-one; MFCD03826478
Molecular Structure CAS#: 60728-92-9, 4-(3-Nitro-1H-1,2,4-Triazol-1-Yl)-2-Butanone
Molecular Formula C6H8N4O3
Molecular Weight 184.15
CAS Registry Number 60728-92-9
SMILES CC(=O)CCN1C=NC(=N1)[N+](=O)[O-]
InChI 1S/C6H8N4O3/c1-5(11)2-3-9-4-7-6(8-9)10(12)13/h4H,2-3H2,1H3
InChIKey TVOPQTRZSBLUNV-UHFFFAOYSA-N
Properties
Density 1.5±0.1g/cm3 (Cal.)
Boiling point 415.3±47.0°C at 760 mmHg (Cal.)
Flash point 204.9±29.3°C (Cal.)
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