(3-Benzylsulfanyl-[1,2,4]triazol-4-yl)-(3,4-dimethoxy-benzylidene)-amine

Base Information

• Chemical Name: (3-Benzylsulfanyl-[1,2,4]triazol-4-yl)-(3,4-dimethoxy-benzylidene)-amine
• CAS No.: 5807-83-0
• Molecular Formula: C18H18N4O2S
• Molecular Weight: 354.4261
• DSSTox Substance ID: DTXSID40417133

Synonyms:5807-83-0;(3-Benzylsulfanyl-[1,2,4]triazol-4-yl)-(3,4-dimethoxy-benzylidene)-amine;AG-690/11383073;(E)-N-(3-benzylsulfanyl-1,2,4-triazol-4-yl)-1-(3,4-dimethoxyphenyl)methanimine;DTXSID40417133;JZTRJKQDMGFYFU-RGVLZGJSSA-N;AKOS001570047;AKOS002233619;BIM-0031023.P001;3-(benzylsulfanyl)-N-(3,4-dimethoxybenzylidene)-4H-1,2,4-triazol-4-amine;3-(BENZYLTHIO)-N-(3,4-DIMETHOXYBENZYLIDENE)-4H-1,2,4-TRIAZOL-4-AMINE

Chemical Property of (3-Benzylsulfanyl-[1,2,4]triazol-4-yl)-(3,4-dimethoxy-benzylidene)-amine

Chemical Property:

• Vapor Pressure: 3.72E-12mmHg at 25°C
• Boiling Point: 550.3°Cat760mmHg
• Flash Point: 286.6°C
• Density: 1.23g/cm³
• XLogP3: 3.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 7
• Exact Mass: 354.11504700
• Heavy Atom Count: 25
• Complexity: 420

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=C(C=C(C=C1)C=NN2C=NN=C2SCC3=CC=CC=C3)OC
• Isomeric SMILES: COC1=C(C=C(C=C1)/C=N/N2C=NN=C2SCC3=CC=CC=C3)OC

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