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Home >> Chemical Listing >> Page 2553 >> 3-(5-Thioxo-1,5-dihydro-4H-1,2,4-triazol-4-yl)propanenitrile

3-(5-Thioxo-1,5-dihydro-4H-1,2,4-triazol-4-yl)propanenitrile
[CAS# 774140-20-4]

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Identification
Name 3-(5-Thioxo-1,5-dihydro-4H-1,2,4-triazol-4-yl)propanenitrile
Synonyms 3-(5-thioxo-1H-1,2,4-triazol-4(5H)-yl)propanenitrile
Molecular Structure CAS#: 774140-20-4, 3-(5-Thioxo-1,5-dihydro-4H-1,2,4-triazol-4-yl)propanenitrile
Molecular Formula C5H6N4S
Molecular Weight 154.19
CAS Registry Number 774140-20-4
SMILES c1n[nH]c(=S)n1CCC#N
InChI 1S/C5H6N4S/c6-2-1-3-9-4-7-8-5(9)10/h4H,1,3H2,(H,8,10)
InChIKey JWBQBOJPEUPSBH-UHFFFAOYSA-N
Properties
Density 1.401g/cm3 (Cal.)
Boiling point 282.932°C at 760 mmHg (Cal.)
Flash point 124.913°C (Cal.)
Refractive index 1.696 (Cal.)
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