s-Triazole-2-thiol, 5-(4-biphenylyloxymethyl)-1-(o-methoxyphenyl)-

Base Information

• Chemical Name: s-Triazole-2-thiol, 5-(4-biphenylyloxymethyl)-1-(o-methoxyphenyl)-
• CAS No.: 68869-47-6
• Molecular Formula: C22H19N3O2S
• Molecular Weight: 389.4702
• DSSTox Substance ID: DTXSID90218955
• Wikidata: Q83095866
• Mol file: 68869-47-6.mol

Synonyms:s-Triazole-2-thiol, 5-(4-biphenylyloxymethyl)-1-(o-methoxyphenyl)-;68869-47-6;5-(4-Biphenoxymethyl)-1-(2-methoxyphenyl)-1H-1,2,4-triazole-2-thiol;3H-1,2,4-Triazole-3-thione, 2,4-dihydro-5-((1,1'-biphenyl-4-yloxy)methyl)-4-(2-methoxyphenyl)-;C22H19N3O2S;DTXSID90218955;LS-156125

Chemical Property of s-Triazole-2-thiol, 5-(4-biphenylyloxymethyl)-1-(o-methoxyphenyl)-

Chemical Property:

• Vapor Pressure: 3.63E-12mmHg at 25°C
• Boiling Point: 550.5°Cat760mmHg
• Flash Point: 286.7°C
• PSA: 87.97000
• Density: 1.24g/cm³
• LogP: 4.81060
• XLogP3: 4.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 6
• Exact Mass: 389.11979803
• Heavy Atom Count: 28
• Complexity: 556

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC=CC=C1N2C(=NNC2=S)COC3=CC=C(C=C3)C4=CC=CC=C4