2-Methyl-3-pent-2-enylcyclopent-2-enone

Base Information

• Chemical Name: 2-Methyl-3-pent-2-enylcyclopent-2-enone
• CAS No.: 11050-62-7
• Deprecated CAS: 8029-70-7
• Molecular Formula: C11H16 O
• Molecular Weight: 164.27
• DSSTox Substance ID: DTXSID6051568
• Mol file: 11050-62-7.mol

Synonyms:DTXSID6051568

Chemical Property of 2-Methyl-3-pent-2-enylcyclopent-2-enone

Chemical Property:

• Appearance/Colour: colorless to light yellow liquid
• Vapor Pressure: 0.0201mmHg at 25°C
• Refractive Index: 1.491
• Boiling Point: 252 C @ 760 mmHg
• Flash Point: 230 deg F (CC)
• PSA: 17.07000
• Density: 0.937g/cm³
• LogP: 3.02210
• XLogP3: 2.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 164.120115130
• Heavy Atom Count: 12
• Complexity: 233

Purity/Quality:

98%,99%, ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC=CCC1=C(C(=O)CC1)C
• Description: Isojasmone has a green odor reminiscent of jasmine.