Heptane-1-sulfinic acid

Base Information

• Chemical Name: Heptane-1-sulfinic acid
• CAS No.: 61668-17-5
• Molecular Formula: C7H16O2S
• DSSTox Substance ID: DTXSID90494919
• Wikidata: Q82342670

Synonyms:HEPTANE-1-SULFINIC ACID;Thioctansaure;61668-17-5;SCHEMBL10013068;DTXSID90494919

Chemical Property of Heptane-1-sulfinic acid

Chemical Property:

• XLogP3: 2.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 6
• Exact Mass: 164.08710092
• Heavy Atom Count: 10
• Complexity: 93.6

Purity/Quality:

99% ^*data from raw suppliers

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MSDS Files:

Useful:

• Canonical SMILES: CCCCCCCS(=O)O

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