Octyl 3-methylbenzoate

Base Information

• Chemical Name: Octyl 3-methylbenzoate
• CAS No.: 16409-24-8
• Molecular Formula: C16H24O2
• Molecular Weight: 248.3606
• NSC Number: 38142
• DSSTox Substance ID: DTXSID20284648
• Wikidata: Q82019695
• Mol file: 16409-24-8.mol

Synonyms:Octyl 3-methylbenzoate;m-Toluic acid, octyl ester;16409-24-8;Octyl 3-methylbenzoate #;m-Toluylic acid, octyl ester;SCHEMBL6057350;DTXSID20284648;HGEOTNHWCJQOTI-UHFFFAOYSA-N;NSC38142;NSC-38142

Chemical Property of Octyl 3-methylbenzoate

Chemical Property:

• Vapor Pressure: 9.98E-05mmHg at 25°C
• Boiling Point: 338.2°Cat760mmHg
• Flash Point: 151.5°C
• Density: 0.958g/cm³
• XLogP3: 6.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 9
• Exact Mass: 248.177630004
• Heavy Atom Count: 18
• Complexity: 225

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCOC(=O)C1=CC=CC(=C1)C

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