Ethyl 3-acetoxyoctanoate

Base Information

• Chemical Name: Ethyl 3-acetoxyoctanoate
• CAS No.: 85554-66-1
• Molecular Formula: C12H22O4
• Molecular Weight: 230.3007
• European Community (EC) Number: 287-598-9
• DSSTox Substance ID: DTXSID90868914
• Nikkaji Number: J310.672A
• Mol file: 85554-66-1.mol

Synonyms:ethyl 3-acetoxyoctanoate;ethyl 3-acetyloxyoctanoate;85554-66-1;Ethyl 3-(acetoxy)octanoate;EINECS 287-598-9;ethyl3-acetoxyoctanoate;DTXSID90868914;ETHYL 3-(ACETYLOXY)OCTANOATE;3-(Acetyloxy)octanoic acid ethyl ester

Chemical Property of Ethyl 3-acetoxyoctanoate

Chemical Property:

• Vapor Pressure: 0.0378mmHg at 25°C
• Boiling Point: 240.5°Cat760mmHg
• Flash Point: 102.2°C
• PSA: 52.60000
• Density: 0.984g/cm³
• LogP: 2.45160
• XLogP3: 2.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 10
• Exact Mass: 230.15180918
• Heavy Atom Count: 16
• Complexity: 213

Purity/Quality:

98.5% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCC(CC(=O)OCC)OC(=O)C