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Home >> Chemical Listing >> Page 318 >> 1-(3-Nitro-1H-1,2,4-Triazol-1-Yl)Ethanone

1-(3-Nitro-1H-1,2,4-Triazol-1-Yl)Ethanone
[CAS# 129053-61-8]

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Identification
Name 1-(3-Nitro-1H-1,2,4-Triazol-1-Yl)Ethanone
Synonyms 1-(3-nitro-1H-1,2,4-triazol-1-yl)ethanone
Molecular Structure CAS#: 129053-61-8, 1-(3-Nitro-1H-1,2,4-Triazol-1-Yl)Ethanone
Molecular Formula C4H4N4O3
Molecular Weight 156.10
CAS Registry Number 129053-61-8
SMILES CC(=O)n1cnc(n1)[N+](=O)[O-]
InChI 1S/C4H4N4O3/c1-3(9)7-2-5-4(6-7)8(10)11/h2H,1H3
InChIKey XPWNJKMIUKCMLT-UHFFFAOYSA-N
Properties
Density 1.728g/cm3 (Cal.)
Boiling point 388.969°C at 760 mmHg (Cal.)
Flash point 189.042°C (Cal.)
Refractive index 1.697 (Cal.)
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