Edgeworthin

Base Information

• Chemical Name: Edgeworthin
• CAS No.: 53947-90-3
• Molecular Formula: C18H10O7
• Molecular Weight: 338.2678
• DSSTox Substance ID: DTXSID70968749
• Nikkaji Number: J2.097.884H
• Wikidata: Q82951638
• Metabolomics Workbench ID: 136145
• ChEMBL ID: CHEMBL462972
• Mol file: 53947-90-3.mol

Synonyms:edgeworthin

Chemical Property of Edgeworthin

Chemical Property:

• Vapor Pressure: 4.81E-19mmHg at 25°C
• Boiling Point: 678.7°Cat760mmHg
• PKA: 7.35±0.20(Predicted)
• Flash Point: 256.1°C
• PSA: 110.11000
• Density: 1.617g/cm³
• LogP: 3.10290
• XLogP3: 2.9
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 2
• Exact Mass: 338.04265265
• Heavy Atom Count: 25
• Complexity: 625

Purity/Quality:

98% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC2=C1C=CC(=O)O2)OC3=CC4=CC(=C(C=C4OC3=O)O)O

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