2,5-Dimethylheptyl 4-methyloctyl phthalate

Base Information

• Chemical Name: 2,5-Dimethylheptyl 4-methyloctyl phthalate
• CAS No.: 85851-76-9
• Molecular Formula: C26H42 O4
• Molecular Weight: 418.60928
• European Community (EC) Number: 288-635-1
• DSSTox Substance ID: DTXSID401006419
• Nikkaji Number: J310.886D
• Mol file: 85851-76-9.mol

Synonyms:2,5-Dimethylheptyl 4-methyloctyl phthalate;85851-76-9;EINECS 288-635-1;DTXSID401006419;2,5-Dimethylheptyl 4-methyloctyl benzene-1,2-dicarboxylate;1,2-Benzenedicarboxylic acid 1-(2,5-dimethylheptyl)2-(4-methyloctyl) ester

Chemical Property of 2,5-Dimethylheptyl 4-methyloctyl phthalate

Chemical Property:

• Vapor Pressure: 2.48E-06mmHg at 25°C
• Boiling Point: 391.4°C at 760 mmHg
• Flash Point: 208.2°C
• PSA: 52.60000
• Density: 0.972g/cm³
• LogP: 7.06910
• XLogP3: 8.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 17
• Exact Mass: 418.30830982
• Heavy Atom Count: 30
• Complexity: 476

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCC(C)CCCOC(=O)C1=CC=CC=C1C(=O)OCC(C)CCC(C)CC