Isobutyl 2-ethylhexyl phthalate

Base Information

• Chemical Name: Isobutyl 2-ethylhexyl phthalate
• CAS No.: 61827-64-3
• Molecular Formula: C20H30 O4
• Molecular Weight: 334.4498
• European Community (EC) Number: 263-256-4
• NSC Number: 17077
• DSSTox Substance ID: DTXSID70885927
• Nikkaji Number: J306.912E
• Mol file: 61827-64-3.mol

Synonyms:61827-64-3;EINECS 263-256-4;2-Ethylhexyl 2-methylpropyl phthalate;1,2-Benzenedicarboxylic acid, 2-ethylhexyl 2-methylpropyl ester;1,2-Benzenedicarboxylic acid, 1-(2-ethylhexyl) 2-(2-methylpropyl) ester;Isobutyl 2-ethylhexyl phthalate;Phthalic acid, 2-ethylhexyl isobutyl ester;SCHEMBL6401135;DTXSID70885927;NSC17077;NSC 17077;NSC-17077;1, 2-ethylhexyl 2-methylpropyl ester;Phthalic acid 1-(2-ethylhexyl)2-(2-methylpropyl) ester;1-O-(2-Ethylhexyl)2-O-(2-methylpropyl)benzene-1,2-dicarboxylate

Chemical Property of Isobutyl 2-ethylhexyl phthalate

Chemical Property:

• Vapor Pressure: 8.01E-05mmHg at 25°C
• Boiling Point: 341.5°C at 760 mmHg
• Flash Point: 180°C
• PSA: 52.60000
• Density: 1.01g/cm³
• LogP: 4.87260
• XLogP3: 5.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 12
• Exact Mass: 334.21440943
• Heavy Atom Count: 24
• Complexity: 378

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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