(Z)-3-(2,4-dimethoxyphenyl)-2-[(3,4,5-trimethoxybenzoyl)amino]prop-2-enoic acid

Base Information

• Chemical Name: (Z)-3-(2,4-dimethoxyphenyl)-2-[(3,4,5-trimethoxybenzoyl)amino]prop-2-enoic acid
• CAS No.: 5687-17-2
• Molecular Formula: C21H23NO8
• Molecular Weight: 417.4
• DSSTox Substance ID: DTXSID70365613
• Wikidata: Q82150413
• Mol file: 5687-17-2.mol

Synonyms:5687-17-2;(Z)-3-(2,4-dimethoxyphenyl)-2-[(3,4,5-trimethoxybenzoyl)amino]prop-2-enoic acid;AC1LZC9M;DTXSID70365613;AB00093533-01

Chemical Property of (Z)-3-(2,4-dimethoxyphenyl)-2-[(3,4,5-trimethoxybenzoyl)amino]prop-2-enoic acid

Chemical Property:

• Vapor Pressure: 1.62E-19mmHg at 25°C
• XLogP3: 2.8
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 9
• Exact Mass: 417.14236669
• Heavy Atom Count: 30
• Complexity: 596

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: COC1=CC(=C(C=C1)C=C(C(=O)O)NC(=O)C2=CC(=C(C(=C2)OC)OC)OC)OC
• Isomeric SMILES: COC1=CC(=C(C=C1)/C=C(/C(=O)O)\NC(=O)C2=CC(=C(C(=C2)OC)OC)OC)OC