3,8-Dihydroxy-4-methoxy-2-oxochromene-5-carboxylic acid

Base Information

• Chemical Name: 3,8-Dihydroxy-4-methoxy-2-oxochromene-5-carboxylic acid
• CAS No.: 125124-66-5
• Molecular Formula: C11H8 O7
• Molecular Weight: 252.18
• DSSTox Substance ID: DTXSID70154665
• Wikidata: Q83021957
• Mol file: 125124-66-5.mol

Synonyms:3,8-DHMCC;3,8-dihydroxy-4-methoxy-2-oxo-2-H-1-benzopyran-5-carboxylic acid

Chemical Property of 3,8-Dihydroxy-4-methoxy-2-oxochromene-5-carboxylic acid

Chemical Property:

• Vapor Pressure: 4.76E-15mmHg at 25°C
• Boiling Point: 595.9°Cat760mmHg
• Flash Point: 240.2°C
• PSA: 117.20000
• Density: 1.74g/cm³
• LogP: 0.91100
• XLogP3: 0.6
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 2
• Exact Mass: 252.02700259
• Heavy Atom Count: 18
• Complexity: 414

Purity/Quality:

98%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=C(C(=O)OC2=C(C=CC(=C21)C(=O)O)O)O