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Home >> Chemical Listing >> Page 256 >> 1-[(1E)-1,3-Butadien-1-Yl]-1H-1,2,4-Triazole

1-[(1E)-1,3-Butadien-1-Yl]-1H-1,2,4-Triazole
[CAS# 122535-72-2]

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Identification
Name 1-[(1E)-1,3-Butadien-1-Yl]-1H-1,2,4-Triazole
Synonyms (E)-1-(buta-1,3-dien-1-yl)-1H-1,2,4-triazole
Molecular Structure CAS#: 122535-72-2, 1-[(1E)-1,3-Butadien-1-Yl]-1H-1,2,4-Triazole
Molecular Formula C6H7N3
Molecular Weight 121.14
CAS Registry Number 122535-72-2
SMILES C=C/C=C/N1C=NC=N1
InChI 1S/C6H7N3/c1-2-3-4-9-6-7-5-8-9/h2-6H,1H2/b4-3+
InChIKey SIHLKHFJYMLROJ-ONEGZZNKSA-N
Properties
Density 1.0±0.1g/cm3 (Cal.)
Boiling point 242.9±23.0°C at 760 mmHg (Cal.)
Flash point 100.7±22.6°C (Cal.)
Refractive index 1.539 (Cal.)
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