2-(Butylsulfanyl)-5-phenyl-1,3,4-thiadiazole

Base Information

• Chemical Name: 2-(Butylsulfanyl)-5-phenyl-1,3,4-thiadiazole
• CAS No.: 113642-49-2
• Molecular Formula: C12H14N2S2
• DSSTox Substance ID: DTXSID40598198
• Wikidata: Q82493927
• Mol file: 113642-49-2.mol

Synonyms:113642-49-2;2-(BUTYLSULFANYL)-5-PHENYL-1,3,4-THIADIAZOLE;DTXSID40598198;AKOS003055717

Chemical Property of 2-(Butylsulfanyl)-5-phenyl-1,3,4-thiadiazole

Chemical Property:

• XLogP3: 4.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 250.05984080
• Heavy Atom Count: 16
• Complexity: 196

Purity/Quality:

99.90% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCSC1=NN=C(S1)C2=CC=CC=C2

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