2,2,4-Trimethyladipic acid, 6-decyl 1-octyl ester

Base Information

• Chemical Name: 2,2,4-Trimethyladipic acid, 6-decyl 1-octyl ester
• CAS No.: 38495-33-9
• Molecular Formula: C27H52O4
• Molecular Weight: 440.6994
• Wikidata: Q76279881
• Mol file: 38495-33-9.mol

Synonyms:2,2,4-Trimethyladipic acid, 6-decyl 1-octyl ester;2,2,4-Trimethyladipic acid octyl 6-decyl ester;Hexanedioic acid, 2,2,4-trimethyl-, 6-decyl 1-octyl ester

Chemical Property of 2,2,4-Trimethyladipic acid, 6-decyl 1-octyl ester

Chemical Property:

• Vapor Pressure: 1.42E-07mmHg at 25°C
• Boiling Point: 429.3°Cat760mmHg
• Flash Point: 188.7°C
• PSA: 52.60000
• Density: 0.915g/cm³
• LogP: 8.01650
• XLogP3: 9.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 23
• Exact Mass: 440.38656014
• Heavy Atom Count: 31
• Complexity: 445

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCCCOC(=O)CC(C)CC(C)(C)C(=O)OCCCCCCCC
• Isomeric SMILES: CCCCCCCCCCOC(=O)C[C@H](C)CC(C)(C)C(=O)OCCCCCCCC

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