5-Heptyn-1-ol, 1-methanesulfonate

Base Information

• Chemical Name: 5-Heptyn-1-ol, 1-methanesulfonate
• CAS No.: 58944-43-7
• Molecular Formula: C₈H₁₄O₃S
• Molecular Weight: 190.263
• DSSTox Substance ID: DTXSID001299763
• Nikkaji Number: J1.323.902I

Synonyms:DTXSID001299763;5-Heptyn-1-ol, 1-methanesulfonate;58944-43-7

Chemical Property of 5-Heptyn-1-ol, 1-methanesulfonate

Chemical Property:

• XLogP3: 1.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 190.06636548
• Heavy Atom Count: 12
• Complexity: 260

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MSDS Files:

Useful:

• Canonical SMILES: CC#CCCCCOS(=O)(=O)C

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