1H-1,2,4-Triazole, 5-(p-aminophenyl)-, hemihydrate

Base Information

• Chemical Name: 1H-1,2,4-Triazole, 5-(p-aminophenyl)-, hemihydrate
• CAS No.: 69226-79-5
• Molecular Formula: C16H18N8O
• Molecular Weight: 338.3671
• DSSTox Substance ID: DTXSID70219288

Synonyms:5-(p-Aminophenyl)-1H-1,2,4-triazole, hemihydrate;1H-1,2,4-Triazole, 5-(p-aminophenyl)-, hemihydrate;Aniline, 4-(1H-1,2,4-triazol-5-yl)-, hemihydrate;69226-79-5;DTXSID70219288;C8H8N4.1/2H2O;C8-H8-N4.1/2H2-O;LS-155765;Benzenamine, 4-(1H-1,2,4-triazol-3-yl)-, hemihydrate

Chemical Property of 1H-1,2,4-Triazole, 5-(p-aminophenyl)-, hemihydrate

Chemical Property:

• Vapor Pressure: 3.23E-07mmHg at 25°C
• Boiling Point: 418.6°C at 760 mmHg
• Flash Point: 236.4°C
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 2
• Exact Mass: 338.16035723
• Heavy Atom Count: 25
• Complexity: 142

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC=C1C2=NC=NN2)N.C1=CC(=CC=C1C2=NC=NN2)N.O

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