2,2-Dimethyl-4-[(phenylsulfanyl)ethynyl]-3,6-dihydro-2H-pyran

Base Information

• Chemical Name: 2,2-Dimethyl-4-[(phenylsulfanyl)ethynyl]-3,6-dihydro-2H-pyran
• CAS No.: 61464-07-1
• Molecular Formula: C15H16OS
• Molecular Weight: 244.35200
• DSSTox Substance ID: DTXSID10559478
• Wikidata: Q82442218

Synonyms:61464-07-1;DTXSID10559478;2,2-Dimethyl-4-[(phenylsulfanyl)ethynyl]-3,6-dihydro-2H-pyran

Chemical Property of 2,2-Dimethyl-4-[(phenylsulfanyl)ethynyl]-3,6-dihydro-2H-pyran

Chemical Property:

• PSA: 34.53000
• LogP: 3.86490
• XLogP3: 3.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 244.09218630
• Heavy Atom Count: 17
• Complexity: 350

Purity/Quality:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1(CC(=CCO1)C#CSC2=CC=CC=C2)C

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