4H-Thiopyran-4-one, 2,3-dihydro-2,2-dimethyl-6-(methylthio)-

Base Information

• Chemical Name: 4H-Thiopyran-4-one, 2,3-dihydro-2,2-dimethyl-6-(methylthio)-
• CAS No.: 84260-83-3
• Molecular Formula: C8H12OS2
• DSSTox Substance ID: DTXSID50384862
• Wikidata: Q82177262
• ChEMBL ID: CHEMBL4566318

Synonyms:2,2-dimethyl-6-methylsulfanyl-3H-thiopyran-4-one;84260-83-3;4H-Thiopyran-4-one, 2,3-dihydro-2,2-dimethyl-6-(methylthio)-;Maybridge1_005063;CHEMBL4566318;HMS555O03;DTXSID50384862;CCG-44328;6,6-Dimethyl-2-methylthio-4H-thiopyran-4-on;SR-01000634170-1

Chemical Property of 4H-Thiopyran-4-one, 2,3-dihydro-2,2-dimethyl-6-(methylthio)-

Chemical Property:

• XLogP3: 1.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 188.03295735
• Heavy Atom Count: 11
• Complexity: 206

Purity/Quality:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1(CC(=O)C=C(S1)SC)C

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