((4,7-Dimethoxy-5-(3-(4-methoxyphenyl)-1-oxo-2-propenyl)-6-benzofuranyl)oxy)acetic acid

Base Information

• Chemical Name: ((4,7-Dimethoxy-5-(3-(4-methoxyphenyl)-1-oxo-2-propenyl)-6-benzofuranyl)oxy)acetic acid
• CAS No.: 51594-77-5
• Molecular Formula: C22H20O8
• Molecular Weight: 412.3894
• Mol file: 51594-77-5.mol

Synonyms:((4,7-Dimethoxy-5-(3-(4-methoxyphenyl)-1-oxo-2-propenyl)-6-benzofuranyl)oxy)acetic acid;(Methoxy-4' cinnamoyl)-5 dimethoxy-4,7 carboxymethoxy-6 benzofuranne [French];Acetic acid, ((4,7-dimethoxy-5-(3-(4-methoxyphenyl)-1-oxo-2-propenyl)-6-benzofuranyl)oxy)-;(Methoxy-4' cinnamoyl)-5 dimethoxy-4,7 carboxymethoxy-6 benzofuranne;51594-77-5

Chemical Property of ((4,7-Dimethoxy-5-(3-(4-methoxyphenyl)-1-oxo-2-propenyl)-6-benzofuranyl)oxy)acetic acid

Chemical Property:

• Vapor Pressure: 2.12E-18mmHg at 25°C
• Melting Point: 142-142.5 °C(Solv: ethanol (64-17-5))
• Boiling Point: 661.5°C at 760 mmHg
• PKA: 2.80±0.40(Predicted)
• Flash Point: 353.9°C
• PSA: 104.43000
• Density: 1.313g/cm³
• LogP: 3.81810
• XLogP3: 3.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 9
• Exact Mass: 412.11581759
• Heavy Atom Count: 30
• Complexity: 612

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC=C(C=C1)C=CC(=O)C2=C(C3=C(C(=C2OCC(=O)O)OC)OC=C3)OC
• Isomeric SMILES: COC1=CC=C(C=C1)/C=C/C(=O)C2=C(C3=C(C(=C2OCC(=O)O)OC)OC=C3)OC