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Home >> Chemical Listing >> T >> 4-(1H-1,2,4-Triazol-1-yl)-2-butanone

4-(1H-1,2,4-Triazol-1-yl)-2-butanone
[CAS# 884497-49-8]

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Identification
Name 4-(1H-1,2,4-Triazol-1-yl)-2-butanone
Synonyms MFCD05863685
Molecular Structure CAS#: 884497-49-8， 4-(1H-1,2,4-Triazol-1-yl)-2-butanone
Molecular Formula C6H9N3O
Molecular Weight 139.16
CAS Registry Number 884497-49-8
SMILES O=C(CCn1ncnc1)C
InChI 1S/C6H9N3O/c1-6(10)2-3-9-5-7-4-8-9/h4-5H,2-3H2,1H3
InChIKey YEOXPHBIXHBTOZ-UHFFFAOYSA-N
Properties
Density 1.189g/cm3 (Cal.)
Boiling point 291.154°C at 760 mmHg (Cal.)
Flash point 129.885°C (Cal.)
Refractive index 1.569 (Cal.)
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