4-Hydroxy-4-methyl-2-pentynenitrile

Base Information

• Chemical Name: 4-Hydroxy-4-methyl-2-pentynenitrile
• CAS No.: 32837-87-9
• Molecular Formula: C6H7NO
• Molecular Weight: 109.128
• DSSTox Substance ID: DTXSID80450706
• Nikkaji Number: J917.444C
• Wikidata: Q82270508
• Mol file: 32837-87-9.mol

Synonyms:4-Hydroxy-4-methyl-2-pentynenitrile;32837-87-9;2-Pentynenitrile, 4-hydroxy-4-methyl-;DTXSID80450706;SY324801;F86816

Chemical Property of 4-Hydroxy-4-methyl-2-pentynenitrile

Chemical Property:

• Boiling Point: 179.3±42.0 °C(Predicted)
• PSA: 44.02000
• Density: 1.071±0.06 g/cm3(Predicted)
• LogP: 0.28428
• XLogP3: 0.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 109.052763847
• Heavy Atom Count: 8
• Complexity: 182

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C#CC#N)O