(E)-3,4,5-trichloro-2-oxopent-3-enoic acid

Base Information

• Chemical Name: (E)-3,4,5-trichloro-2-oxopent-3-enoic acid
• CAS No.: 99165-90-9
• Molecular Formula: C5H3Cl3O3
• Molecular Weight: 217.4345
• Mol file: 99165-90-9.mol

Synonyms:3-Pentenoic acid, 5,5,?-trichloro-2-oxo-;99165-90-9

Chemical Property of (E)-3,4,5-trichloro-2-oxopent-3-enoic acid

Chemical Property:

• Vapor Pressure: 0.000422mmHg at 25°C
• Boiling Point: 293.5°C at 760 mmHg
• Flash Point: 131.3°C
• PSA: 54.37000
• Density: 1.67g/cm³
• LogP: 1.56810
• XLogP3: 1.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 215.914777
• Heavy Atom Count: 11
• Complexity: 221

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C(C(=C(C(=O)C(=O)O)Cl)Cl)Cl
• Isomeric SMILES: C(/C(=C(/C(=O)C(=O)O)\Cl)/Cl)Cl