2-(6,9-Dihydroxyundecyl)hexadecanoic acid

Base Information

• Chemical Name: 2-(6,9-Dihydroxyundecyl)hexadecanoic acid
• CAS No.: 140868-40-2
• Molecular Formula: C27H54O4
• Molecular Weight: 442.71500
• DSSTox Substance ID: DTXSID00569460
• Mol file: 140868-40-2.mol

Synonyms:140868-40-2;2-(6,9-DIHYDROXYUNDECYL)HEXADECANOIC ACID;DTXSID00569460

Chemical Property of 2-(6,9-Dihydroxyundecyl)hexadecanoic acid

Chemical Property:

• Boiling Point: 571.6±30.0 °C(Predicted)
• PSA: 77.76000
• Density: 0.952±0.06 g/cm3(Predicted)
• LogP: 7.64090
• XLogP3: 9.7
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 24
• Exact Mass: 442.40221020
• Heavy Atom Count: 31
• Complexity: 385

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCCCCCCCC(CCCCCC(CCC(CC)O)O)C(=O)O

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