Tetradecanoic acid, 3-(1,3-benzodioxol-5-yl)-1-(1,1-dimethylethyl)-2-propenyl ester

Base Information

• Chemical Name: Tetradecanoic acid, 3-(1,3-benzodioxol-5-yl)-1-(1,1-dimethylethyl)-2-propenyl ester
• CAS No.: 58344-21-1
• Molecular Formula: C28H44O4
• Molecular Weight: 444.72
• Mol file: 58344-21-1.mol

Synonyms:D 442;Tetradecanoate de ((methylenedioxy-3,4 phenyl)-1 dimethyl-4,4 pentene-1) yle-3 [French];Tetradecanoic acid, 3-(1,3-benzodioxol-5-yl)-1-(1,1-dimethylethyl)-2-propenyl ester;Tetradecanoate de ((methylenedioxy-3,4 phenyl)-1 dimethyl-4,4 pentene-1) yle-3;58344-21-1;LS-148898

Chemical Property of Tetradecanoic acid, 3-(1,3-benzodioxol-5-yl)-1-(1,1-dimethylethyl)-2-propenyl ester

Chemical Property:

• Vapor Pressure: 7.29E-12mmHg at 25°C
• Boiling Point: 543.3°C at 760 mmHg
• Flash Point: 227.8°C
• Density: 1.004g/cm³
• XLogP3: 10.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 17
• Exact Mass: 444.32395988
• Heavy Atom Count: 32
• Complexity: 536

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCCCCCCC(=O)OC(C=CC1=CC2=C(C=C1)OCO2)C(C)(C)C
• Isomeric SMILES: CCCCCCCCCCCCCC(=O)OC(/C=C/C1=CC2=C(C=C1)OCO2)C(C)(C)C