2,4-Octadienal

Base Information

• Chemical Name: 2,4-Octadienal
• CAS No.: 38743-20-3
• Molecular Formula: C8 H16 O
• Molecular Weight: 124.1803
• European Community (EC) Number: 250-147-1,639-066-6
• UNII: PR4J26TQJD
• DSSTox Substance ID: DTXSID00885475
• Nikkaji Number: J127.243H,J2.494.320H
• Wikidata: Q27286719
• Metabolomics Workbench ID: 3432
• Mol file: 38743-20-3.mol

Synonyms:2,4-octadienal;2E,4E-octadienal;2E,6Z-octadienal

Chemical Property of 2,4-Octadienal

Chemical Property:

• Boiling Point: 198.2°Cat760mmHg
• Flash Point: 83°C
• Density: 0.855g/cm³
• XLogP3: 2.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 4
• Exact Mass: 124.088815002
• Heavy Atom Count: 9
• Complexity: 112

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCCC=CC=CC=O
• Isomeric SMILES: CCC/C=C/C=C/C=O