Octanoic acid, tetramethylene ester

Base Information

• Chemical Name: Octanoic acid, tetramethylene ester
• CAS No.: 109-41-1
• Molecular Formula: C20H38 O4
• Molecular Weight: 342.5133
• NSC Number: 6378
• DSSTox Substance ID: DTXSID70278133
• Nikkaji Number: J106.280H
• Wikidata: Q82009754
• Mol file: 109-41-1.mol

Synonyms:109-41-1;butane-1,4-diyl dioctanoate;Octanoic acid, tetramethylene ester;Dioctanoic acid 1,4-butanediyl;SCHEMBL10475977;Octanoic acid,4-butanediyl ester;DTXSID70278133;NSC6378;NSC-6378

Chemical Property of Octanoic acid, tetramethylene ester

Chemical Property:

• Vapor Pressure: 2.34E-07mmHg at 25°C
• Boiling Point: 422.8°Cat760mmHg
• Flash Point: 198°C
• Density: 0.936g/cm³
• XLogP3: 6.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 19
• Exact Mass: 342.27700969
• Heavy Atom Count: 24
• Complexity: 272

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCC(=O)OCCCCOC(=O)CCCCCCC

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