Trimethylolpropane valerate diheptanoate

Base Information

• Chemical Name: Trimethylolpropane valerate diheptanoate
• CAS No.: 71426-94-3
• Molecular Formula: C25H46O6
• Molecular Weight: 442.64
• DSSTox Substance ID: DTXSID001150468
• Nikkaji Number: J446.809K
• Mol file: 71426-94-3.mol

Synonyms:Trimethylolpropane valerate diheptanoate;71426-94-3;Trimethylolpropane pentanoate, diheptanoate;Heptanoic acid, 2-ethyl-2-(((1-oxopentyl)oxy)methyl)-1,3-propanediyl ester;Heptanoic acid, 1,1'-(2-ethyl-2-(((1-oxopentyl)oxy)methyl)-1,3-propanediyl) ester;Heptanoic acid, 2-ethyl-2-[[(1-oxopentyl)oxy]methyl]-1,3-propanediyl ester;DTXSID001150468;1,1'-[2-Ethyl-2-[[(1-oxopentyl)oxy]methyl]-1,3-propanediyl] diheptanoate;Bis(heptanoic acid)2-ethyl-2-[[(1-oxopentyl)oxy]methyl]-1,3-propanediyl ester

Chemical Property of Trimethylolpropane valerate diheptanoate

Chemical Property:

• Vapor Pressure: 2.37E-10mmHg at 25°C
• Boiling Point: 505.7°C at 760 mmHg
• Flash Point: 210.8°C
• PSA: 78.90000
• Density: 0.979g/cm³
• LogP: 6.14340
• XLogP3: 7.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 23
• Exact Mass: 442.32943918
• Heavy Atom Count: 31
• Complexity: 460

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCC(=O)OCC(CC)(COC(=O)CCCC)COC(=O)CCCCCC