1,3-Octanediol monopropionate

Base Information

• Chemical Name: 1,3-Octanediol monopropionate
• CAS No.: 53554-42-0
• Molecular Formula: C11H22O3
• Molecular Weight: 0
• DSSTox Substance ID: DTXSID80968316
• Mol file: 53554-42-0.mol

Synonyms:1,3-Octanediol monopropionate;1,3-Octanediol, monopropanoate;53554-42-0;3-hydroxyoctyl propanoate;SCHEMBL11853122;DTXSID80968316;LS-97894

Chemical Property of 1,3-Octanediol monopropionate

Chemical Property:

• Vapor Pressure: 0.00362mmHg at 25°C
• Boiling Point: 249.6°Cat760mmHg
• Flash Point: 88.9°C
• Density: 0.956g/cm³
• XLogP3: 2.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 9
• Exact Mass: 202.15689456
• Heavy Atom Count: 14
• Complexity: 146

Purity/Quality:

99%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

Useful:

• Canonical SMILES: CCCCCC(CCOC(=O)CC)O