4-(Bis(2-ethylhexyl)amino)-4-oxo-2-butenoic acid

Base Information

• Chemical Name: 4-(Bis(2-ethylhexyl)amino)-4-oxo-2-butenoic acid
• CAS No.: 85508-27-6
• Molecular Formula: C20H37 N O3
• Molecular Weight: 339.51268
• European Community (EC) Number: 287-452-4
• Nikkaji Number: J310.598I
• Mol file: 85508-27-6.mol

Synonyms:4-(Bis(2-ethylhexyl)amino)-4-oxo-2-butenoic acid;85508-27-6;EINECS 287-452-4;4-[BIS(2-ETHYLHEXYL)AMINO]-4-OXO-2-BUTENOIC ACID;4-[bis-(2-Ethylhexyl)amino]-4-oxo-2-butenoic acid

Chemical Property of 4-(Bis(2-ethylhexyl)amino)-4-oxo-2-butenoic acid

Chemical Property:

• Vapor Pressure: 1.13E-10mmHg at 25°C
• Boiling Point: 483.4°C at 760 mmHg
• Flash Point: 246.2°C
• PSA: 57.61000
• Density: 0.964g/cm³
• LogP: 4.88860
• XLogP3: 5.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 14
• Exact Mass: 339.27734404
• Heavy Atom Count: 24
• Complexity: 361

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCC(CC)CN(CC(CC)CCCC)C(=O)C=CC(=O)O
• Isomeric SMILES: CCCCC(CC)CN(CC(CC)CCCC)C(=O)/C=C/C(=O)O