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Home >> Chemical Listing >> Page 504 >> 5-Phenyl-2H-1,2,3-Triazole-4-Carbonitrile

5-Phenyl-2H-1,2,3-Triazole-4-Carbonitrile
[CAS# 14677-11-3]

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Identification
Name 5-Phenyl-2H-1,2,3-Triazole-4-Carbonitrile
Synonyms 4-phenyl-5-cyano-1,2,3-triazole
Molecular Structure CAS#: 14677-11-3, 5-Phenyl-2H-1,2,3-Triazole-4-Carbonitrile
Molecular Formula C9H6N4
Molecular Weight 170.17
CAS Registry Number 14677-11-3
SMILES C1=CC=C(C=C1)C2=NNN=C2C#N
InChI 1S/C9H6N4/c10-6-8-9(12-13-11-8)7-4-2-1-3-5-7/h1-5H,(H,11,12,13)
InChIKey KXACXWLKMFKIHQ-UHFFFAOYSA-N
Properties
Density 1.4±0.1g/cm3 (Cal.)
Boiling point 451.4±33.0°C at 760 mmHg (Cal.)
Flash point 145.1±10.6°C (Cal.)
Refractive index 1.644 (Cal.)
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