Isobutyl isocyanide

Base Information

• Chemical Name: Isobutyl isocyanide
• CAS No.: 590-94-3
• Molecular Formula: C5H9N
• Molecular Weight: 83.1332
• DSSTox Substance ID: DTXSID70207741
• Nikkaji Number: J95.613I
• Wikidata: Q83081720
• Mol file: 590-94-3.mol

Synonyms:Isobutyl isocyanide;1-isocyano-2-methylpropane;590-94-3;Propane, 1-isocyano-2-methyl-;isobutyl isonitrile;1-isocyano-2-methyl-propane;DTXSID70207741;AKOS023200041;GS-0356;EN300-748823;A837350

Chemical Property of Isobutyl isocyanide

Chemical Property:

• Refractive Index: 1.3871
• Boiling Point: 117.25°C (estimate)
• PSA: 0.00000
• Density: 0.7607
• LogP: 0.79240
• XLogP3: 1.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 83.073499291
• Heavy Atom Count: 6
• Complexity: 65.3

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)C[N+]#[C-]