2-(9H-thioxanthen-9-yl)propanedinitrile

Base Information

• Chemical Name: 2-(9H-thioxanthen-9-yl)propanedinitrile
• CAS No.: 52962-53-5
• Molecular Formula: C₁₆H₁₀N₂S
• Molecular Weight: 262.335
• DSSTox Substance ID: DTXSID301281612
• Nikkaji Number: J579.579F

Synonyms:2-(9H-thioxanthen-9-yl)propanedinitrile;DTXSID301281612;52962-53-5

Chemical Property of 2-(9H-thioxanthen-9-yl)propanedinitrile

Chemical Property:

• XLogP3: 3.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 262.05646950
• Heavy Atom Count: 19
• Complexity: 391

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MSDS Files:

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)C(C3=CC=CC=C3S2)C(C#N)C#N

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