1-Isocyano-3-(methylsulfanyl)propane

Base Information

• Chemical Name: 1-Isocyano-3-(methylsulfanyl)propane
• CAS No.: 59479-58-2
• Molecular Formula: C5H9NS
• DSSTox Substance ID: DTXSID90600477
• Wikidata: Q82496579

Synonyms:1-ISOCYANO-3-(METHYLSULFANYL)PROPANE;1-isocyano-3-methylsulfanylpropane;59479-58-2;Propane, 1-isocyano-3-(methylthio)-;SCHEMBL10452698;DTXSID90600477;GS-0564;EN300-1807928

Chemical Property of 1-Isocyano-3-(methylsulfanyl)propane

Chemical Property:

• XLogP3: 0.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 115.04557046
• Heavy Atom Count: 7
• Complexity: 71.4

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CSCCC[N+]#[C-]

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