Diheptylundecyl adipate

Base Information

• Chemical Name: Diheptylundecyl adipate
• CAS No.: 155613-91-5
• Molecular Formula: C42H82 O4
• Molecular Weight: 496.8057
• UNII: 000BPI4XCV
• DSSTox Substance ID: DTXSID40904619
• Wikidata: Q27231294
• Mol file: 155613-91-5.mol

Synonyms:DIHEPTYLUNDECYL ADIPATE;155613-91-5;000BPI4XCV;bis(2-heptylundecyl) hexanedioate;NS-218;UNII-000BPI4XCV;Hexanedioic acid, bis(2-heptylundecyl) ester;Hexanedioic acid, 1,6-bis(2-heptylundecyl) ester;Bis(2-heptylundecyl) adipate;SCHEMBL295425;DTXSID40904619;DIHEPTYLUNDECYL ADIPATE [INCI];Q27231294

Chemical Property of Diheptylundecyl adipate

Chemical Property:

• Boiling Point: 584.0±18.0 °C(Predicted)
• PSA: 63.60000
• Density: 0.892±0.06 g/cm3(Predicted)
• LogP: 10.94540
• XLogP3: 17.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 39
• Exact Mass: 650.62131109
• Heavy Atom Count: 46
• Complexity: 579

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

Useful:

• Canonical SMILES: CCCCCCCCCC(CCCCCCC)COC(=O)CCCCC(=O)OCC(CCCCCCC)CCCCCCCCC

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