2,6,7-Trioxabicyclo(2.2.2)octane, 1-(4-ethynylphenyl)-4-(2-methylpropyl)-

Base Information

• Chemical Name: 2,6,7-Trioxabicyclo(2.2.2)octane, 1-(4-ethynylphenyl)-4-(2-methylpropyl)-
• CAS No.: 108614-28-4
• Molecular Formula: C17H20 O3
• Molecular Weight: 272.3389
• DSSTox Substance ID: DTXSID40148637
• Wikidata: Q83014212
• Mol file: 108614-28-4.mol

Synonyms:1-(4-Ethynylphenyl)-4-(2-methylpropyl)-2,6,7-trioxabicyclo(2.2.2)octane;2,6,7-Trioxabicyclo(2.2.2)octane, 1-(4-ethynylphenyl)-4-(2-methylpropyl)-;108614-28-4;SCHEMBL9208626;DTXSID40148637;LS-157612

Chemical Property of 2,6,7-Trioxabicyclo(2.2.2)octane, 1-(4-ethynylphenyl)-4-(2-methylpropyl)-

Chemical Property:

• Vapor Pressure: 9.84E-05mmHg at 25°C
• Boiling Point: 348.9°Cat760mmHg
• Flash Point: 117.4°C
• Density: 1.14g/cm³
• XLogP3: 2.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 272.14124450
• Heavy Atom Count: 20
• Complexity: 373

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)CC12COC(OC1)(OC2)C3=CC=C(C=C3)C#C