5-propan-2-ylsulfanyl-1H-1,2,4-triazole

Base Information

• Chemical Name: 5-propan-2-ylsulfanyl-1H-1,2,4-triazole
• CAS No.: 71705-08-3
• Molecular Formula: C5H9 N3 S
• Molecular Weight: 143.21006
• NSC Number: 326136
• DSSTox Substance ID: DTXSID80318094
• Wikidata: Q82073323
• Mol file: 71705-08-3.mol

Synonyms:71705-08-3;NSC 326136;5-propan-2-ylsulfanyl-1H-1,2,4-triazole;NSC326136;SCHEMBL755197;SCHEMBL12221456;SCHEMBL16186178;3-isopropylthio-1,2,4-triazole;DTXSID80318094;NSC-326136

Chemical Property of 5-propan-2-ylsulfanyl-1H-1,2,4-triazole

Chemical Property:

• Vapor Pressure: 0.00202mmHg at 25°C
• Boiling Point: 290.9°C at 760 mmHg
• Flash Point: 129.7°C
• PSA: 66.87000
• Density: 1.2g/cm³
• LogP: 1.30520
• XLogP3: 1.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 143.05171847
• Heavy Atom Count: 9
• Complexity: 86.3

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)SC1=NC=NN1