(E)-2,6-Dimethylocta-1,5,7-trien-3-yl acetate

Base Information

• Chemical Name: (E)-2,6-Dimethylocta-1,5,7-trien-3-yl acetate
• CAS No.: 61931-78-0
• Molecular Formula: C12H18O2
• Molecular Weight: 194.27
• European Community (EC) Number: 263-335-3
• DSSTox Substance ID: DTXSID701214647
• Nikkaji Number: J306.948F
• Mol file: 61931-78-0.mol

Synonyms:61931-78-0;(E)-2,6-Dimethylocta-1,5,7-trien-3-yl acetate;2,6-Dimethyl-5,7-octadien-2-yl acetate;EINECS 263-335-3;1,5,7-Octatrien-3-ol, 2,6-dimethyl-, acetate, (5E)-;1,5,7-Octatrien-3-ol, 2,6-dimethyl-, 3-acetate, (5E)-;DTXSID701214647;AKOS006272751;(5E)-2,6-Dimethyl-1,5,7-octatrien-3-ol acetate;1,5,7-Octatrien-3-ol, 2,6-dimethyl-, acetate, (E)-

Chemical Property of (E)-2,6-Dimethylocta-1,5,7-trien-3-yl acetate

Chemical Property:

• Vapor Pressure: 0.0143mmHg at 25°C
• Boiling Point: 257.7°C at 760 mmHg
• Flash Point: 93.8°C
• PSA: 26.30000
• Density: 0.908g/cm³
• LogP: 3.01660
• XLogP3: 3.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 6
• Exact Mass: 194.130679813
• Heavy Atom Count: 14
• Complexity: 262

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=C(C)C=C)OC(=O)C
• Isomeric SMILES: CC(=C)C(C/C=C(\C)/C=C)OC(=O)C