(2Z,4E)-4-hydroxy-6-oxohexa-2,4-dienoic acid

Base Information

• Chemical Name: (2Z,4E)-4-hydroxy-6-oxohexa-2,4-dienoic acid
• CAS No.: 114828-85-2
• Molecular Formula: C6H6 O4
• Molecular Weight: 142.1094
• Metabolomics Workbench ID: 51224
• Mol file: 114828-85-2.mol

Synonyms:(2Z,4E)-4-hydroxy-6-oxohexa-2,4-dienoic acid;114828-85-2;(2Z,5E)-6-hydroxy-4-oxohexa-2,5-dienoic acid;cis,trans-4-Hydroxymuconic semialdehyde;cis,cis-4-Hydroxymuconic semialdehyde;2,4-Hexadienoic acid, 4-hydroxy-6-oxo-, (Z,Z)-;CHEBI:18301;(2Z,4E)-4-hydroxymuconic semialdehyde;C06603

Chemical Property of (2Z,4E)-4-hydroxy-6-oxohexa-2,4-dienoic acid

Chemical Property:

• Vapor Pressure: 2.51E-05mmHg at 25°C
• Boiling Point: 320.8°Cat760mmHg
• Flash Point: 162°C
• Density: 1.365g/cm³
• XLogP3: 0.2
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 142.02660867
• Heavy Atom Count: 10
• Complexity: 190

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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