3-(2-((2-(2-Oxo-1,3-benzothiazol-3(2H)-yl)ethyl)dithio)ethyl)-1,3-benzothiazol-2(3H)-one

Base Information

• Chemical Name: 3-(2-((2-(2-Oxo-1,3-benzothiazol-3(2H)-yl)ethyl)dithio)ethyl)-1,3-benzothiazol-2(3H)-one
• CAS No.: 18331-47-0
• Molecular Formula: C18H16N2O2S4
• Molecular Weight: 420.5918
• NSC Number: 125828
• DSSTox Substance ID: DTXSID80171409
• Wikidata: Q83041488

Synonyms:NSC125828;18331-47-0;3-(2-((2-(2-Oxo-1,3-benzothiazol-3(2H)-yl)ethyl)dithio)ethyl)-1,3-benzothiazol-2(3H)-one;NSC 125828;DTXSID80171409;NSC-125828;3-[2-[2-(2-oxo-1,3-benzothiazol-3-yl)ethyldisulfanyl]ethyl]-1,3-benzothiazol-2-one

Chemical Property of 3-(2-((2-(2-Oxo-1,3-benzothiazol-3(2H)-yl)ethyl)dithio)ethyl)-1,3-benzothiazol-2(3H)-one

Chemical Property:

• Boiling Point: 635.4°Cat760mmHg
• Flash Point: 338.1°C
• Density: 1.472g/cm³
• XLogP3: 4.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 7
• Exact Mass: 420.00946245
• Heavy Atom Count: 26
• Complexity: 489

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MSDS Files:

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)N(C(=O)S2)CCSSCCN3C4=CC=CC=C4SC3=O

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