Tridecyl isononanoate

Base Information

• Chemical Name: Tridecyl isononanoate
• CAS No.: 125804-18-4
• Molecular Formula: C22H44 O2
• Molecular Weight: 340.58356
• UNII: 0539372G7G
• DSSTox Substance ID: DTXSID60432388
• Wikidata: Q27236064
• Mol file: 125804-18-4.mol

Synonyms:Tridecyl isononanoate;125804-18-4;Tridecyl 7-methyloctanoate;Isononanoic acid, tridecyl ester;UNII-0539372G7G;0539372G7G;DTXSID60432388;TRIDECYL ISONONANOATE [INCI];Q27236064;Hexanoic acid, 3, 5, 5- trimethyl- , tridecyl ester

Chemical Property of Tridecyl isononanoate

Chemical Property:

• PSA: 26.30000
• LogP: 7.44710
• XLogP3: 9.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 19
• Exact Mass: 340.334130642
• Heavy Atom Count: 24
• Complexity: 261

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCCCCCCOC(=O)CCCCCC(C)C

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