2-{[2-(1,3-Benzothiazol-2-ylsulfanyl)ethyl]sulfanyl}-1,3-benzothiazole

Base Information

• Chemical Name: 2-{[2-(1,3-Benzothiazol-2-ylsulfanyl)ethyl]sulfanyl}-1,3-benzothiazole
• CAS No.: 7133-50-8
• Molecular Formula: C₁₆H₁₂N₂S₄
• Molecular Weight: 360.549
• NSC Number: 190382
• DSSTox Substance ID: DTXSID90307217
• Nikkaji Number: J2.462.323H
• Wikidata: Q82054583
• Pharos Ligand ID: RD12RJDDD1WC
• ChEMBL ID: CHEMBL1515736
• Mol file: 7133-50-8.mol

Synonyms:NSC190382;7133-50-8;2-{[2-(1,3-benzothiazol-2-ylsulfanyl)ethyl]sulfanyl}-1,3-benzothiazole;NSC-190382;CBDivE_008255;SCHEMBL5837665;CHEMBL1515736;DTXSID90307217;1,2-di(2-benzothiazolylthio)ethane;CCG-36928;NCGC00014538;NCI190382;STK834830;AKOS000525433;NCGC00014538-02;NCGC00097642-01;1,2-bis(benzothiazol-2-ylsulfanyl)ethane;NCI60_001586;2,2'-(1,2-ethanediyldithio)bis(1,3-benzothiazole);2,2'-[1,2-Ethanediylbis(thio)]bis-1,3-benzothiazole;2,2'-(ethane-1,2-diyldisulfanediyl)bis(1,3-benzothiazole);2-((2-(1,3-benzothiazol-2-ylthio)ethyl)thio)-1,3-benzothiazole

Chemical Property of 2-{[2-(1,3-Benzothiazol-2-ylsulfanyl)ethyl]sulfanyl}-1,3-benzothiazole

Chemical Property:

• Boiling Point: 546.6°Cat760mmHg
• Flash Point: 284.4°C
• Density: 1.47g/cm³
• XLogP3: 6.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 5
• Exact Mass: 359.98833309
• Heavy Atom Count: 22
• Complexity: 336

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)N=C(S2)SCCSC3=NC4=CC=CC=C4S3