2-Butenedioic acid (2Z)-, bis(2-ethylbutyl) ester

Base Information

• Chemical Name: 2-Butenedioic acid (2Z)-, bis(2-ethylbutyl) ester
• CAS No.: 67939-99-5
• Molecular Formula: C16H28O4
• Molecular Weight: 284.39
• DSSTox Substance ID: DTXSID7070890
• Mol file: 67939-99-5.mol

Synonyms:2-Butenedioic acid (2Z)-, bis(2-ethylbutyl) ester;2-Butenedioic acid (Z), bis-2-ethylbutyl ester;2-Butenedioic acid (2Z)-, 1,4-bis(2-ethylbutyl) ester;67939-99-5;2-Butenedioic acid (Z)-, bis(2-ethylbutyl) ester;SCHEMBL1453623;DTXSID7070890;JXHKBPVSQSRMKJ-MDZDMXLPSA-N;Fumaric acid, di(2-ethylbutyl) ester

Chemical Property of 2-Butenedioic acid (2Z)-, bis(2-ethylbutyl) ester

Chemical Property:

• Vapor Pressure: 4.51E-05mmHg at 25°C
• Boiling Point: 350.1°C at 760 mmHg
• Flash Point: 161.7°C
• PSA: 52.60000
• Density: 0.967g/cm³
• LogP: 3.50140
• XLogP3: 4.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 12
• Exact Mass: 284.19875937
• Heavy Atom Count: 20
• Complexity: 272

Purity/Quality:

99%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC(CC)COC(=O)C=CC(=O)OCC(CC)CC
• Isomeric SMILES: CCC(CC)COC(=O)/C=C/C(=O)OCC(CC)CC