1-Methyl-4-[2-(methylsulfanyl)-9H-xanthen-9-ylidene]piperidine

Base Information

• Chemical Name: 1-Methyl-4-[2-(methylsulfanyl)-9H-xanthen-9-ylidene]piperidine
• CAS No.: 60085-80-5
• Molecular Formula: C20H21NOS
• DSSTox Substance ID: DTXSID40605957
• Wikidata: Q82504440

Synonyms:60085-80-5;SCHEMBL11575486;DTXSID40605957;1-METHYL-4-[2-(METHYLSULFANYL)-9H-XANTHEN-9-YLIDENE]PIPERIDINE

Chemical Property of 1-Methyl-4-[2-(methylsulfanyl)-9H-xanthen-9-ylidene]piperidine

Chemical Property:

• XLogP3: 3.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 323.13438547
• Heavy Atom Count: 23
• Complexity: 453

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN1CCC(=C2C3=CC=CC=C3OC4=C2C=C(C=C4)SC)CC1

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