2-(3-Ethoxy-3-oxoprop-1-enyl)phenyl butyrate

Base Information

• Chemical Name: 2-(3-Ethoxy-3-oxoprop-1-enyl)phenyl butyrate
• CAS No.: 94030-84-9
• Molecular Formula: C15H18 O4
• Molecular Weight: 262.30102
• European Community (EC) Number: 301-689-3
• Nikkaji Number: J349.018A
• Mol file: 94030-84-9.mol

Synonyms:2-(3-Ethoxy-3-oxoprop-1-enyl)phenyl butyrate;94030-84-9;EINECS 301-689-3;[2-[(E)-3-ethoxy-3-oxoprop-1-enyl]phenyl] butanoate;Butanoic acid 2-(3-ethoxy-3-oxo-1-propenyl)phenyl ester;Butanoic acid, 2-(3-ethoxy-3-oxo-1-propenyl)phenyl ester

Chemical Property of 2-(3-Ethoxy-3-oxoprop-1-enyl)phenyl butyrate

Chemical Property:

• Vapor Pressure: 5.86E-06mmHg at 25°C
• Boiling Point: 379.4°Cat760mmHg
• Flash Point: 186.5°C
• PSA: 52.60000
• Density: 1.104g/cm³
• LogP: 2.96840
• XLogP3: 3.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 8
• Exact Mass: 262.12050905
• Heavy Atom Count: 19
• Complexity: 322

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCC(=O)OC1=CC=CC=C1C=CC(=O)OCC
• Isomeric SMILES: CCCC(=O)OC1=CC=CC=C1/C=C/C(=O)OCC