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Home >> Chemical Listing >> Page 2774 >> 5-Phenyl-3-(2,4-Xylyl)-1H-1,2,4-Triazole

5-Phenyl-3-(2,4-Xylyl)-1H-1,2,4-Triazole
[CAS# 85303-90-8]

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Identification
Name 5-Phenyl-3-(2,4-Xylyl)-1H-1,2,4-Triazole
Synonyms 5-Phenyl-3-(2,4-Xylyl)-S-Triazole; Brn 5552524; S-Triazole, 5-Phenyl-3-(2,4-Xylyl)-
Molecular Structure CAS#: 85303-90-8, 5-Phenyl-3-(2,4-Xylyl)-1H-1,2,4-Triazole
Molecular Formula C16H15N3
Molecular Weight 249.31
CAS Registry Number 85303-90-8
SMILES C1=C(C=CC(=C1C)C2=NC(=N[NH]2)C3=CC=CC=C3)C
InChI 1S/C16H15N3/c1-11-8-9-14(12(2)10-11)16-17-15(18-19-16)13-6-4-3-5-7-13/h3-10H,1-2H3,(H,17,18,19)
InChIKey LXVXIEDVPDPIGJ-UHFFFAOYSA-N
Properties
Density 1.147g/cm3 (Cal.)
Boiling point 458.126°C at 760 mmHg (Cal.)
Flash point 209.814°C (Cal.)
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