(10Z)-14-pentyl-1-oxacyclotetradec-10-ene-2,13-dione

Base Information

• Chemical Name: (10Z)-14-pentyl-1-oxacyclotetradec-10-ene-2,13-dione
• CAS No.: 114416-55-6
• Molecular Formula: C18H30 O3
• Molecular Weight: 294.43
• Mol file: 114416-55-6.mol

Synonyms:12-keto-9(2)-octadecen-13-olide;12-KO13O

Chemical Property of (10Z)-14-pentyl-1-oxacyclotetradec-10-ene-2,13-dione

Chemical Property:

• Vapor Pressure: 2.08E-08mmHg at 25°C
• Boiling Point: 453.4°Cat760mmHg
• Flash Point: 197.9°C
• PSA: 43.37000
• Density: 0.941g/cm³
• LogP: 4.73820
• XLogP3: 5.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 294.21949481
• Heavy Atom Count: 21
• Complexity: 333

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCC1C(=O)CC=CCCCCCCCC(=O)O1
• Isomeric SMILES: CCCCCC1C(=O)C/C=C\CCCCCCCC(=O)O1