2-Methyl-5,6-dihydro-1,4-oxathiine-3-carbothioic S-acid

Base Information

• Chemical Name: 2-Methyl-5,6-dihydro-1,4-oxathiine-3-carbothioic S-acid
• CAS No.: 88258-80-4
• Molecular Formula: C6H8O2S2
• DSSTox Substance ID: DTXSID30525256
• Wikidata: Q82392717

Synonyms:88258-80-4;2-Methyl-5,6-dihydro-1,4-oxathiine-3-carbothioic S-acid;DTXSID30525256

Chemical Property of 2-Methyl-5,6-dihydro-1,4-oxathiine-3-carbothioic S-acid

Chemical Property:

• XLogP3: 0.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 175.99657184
• Heavy Atom Count: 10
• Complexity: 186

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(SCCO1)C(=O)S

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