1,3-Dihydroxy-2-methoxy-11H-benzofuro[2,3-b][1]benzopyran-11-one

Base Information

• Chemical Name: 1,3-Dihydroxy-2-methoxy-11H-benzofuro[2,3-b][1]benzopyran-11-one
• CAS No.: 132915-51-6
• Molecular Formula: C16H10O6
• Molecular Weight: 298.25
• DSSTox Substance ID: DTXSID50157851
• Nikkaji Number: J373.297E
• Wikidata: Q83026016
• Mol file: 132915-51-6.mol

Synonyms:Ayamenin A;132915-51-6;1,3-Dihydroxy-2-methoxy-11H-benzofuro[2,3-b][1]benzopyran-11-one;1,3-dihydroxy-2-methoxy-[1]benzofuro[2,3-b]chromen-11-one;1,3-Dihydroxy-2-methoxy-(1)benzoxolo(2,3-b)chromen-11-one;DTXSID50157851;InChI=1/C16H10O6/c1-20-15-8(17)6-10-12(14(15)19)13(18)11-7-4-2-3-5-9(7)21-16(11)22-10/h2-6,17,19H,1H

Chemical Property of 1,3-Dihydroxy-2-methoxy-11H-benzofuro[2,3-b][1]benzopyran-11-one

Chemical Property:

• Vapor Pressure: 1.09E-12mmHg at 25°C
• Melting Point: 233-234 °C
• Boiling Point: 549.6°C at 760 mmHg
• PKA: 6.65±0.20(Predicted)
• Flash Point: 286.2°C
• PSA: 93.04000
• Density: 1.558g/cm³
• LogP: 3.11220
• XLogP3: 3.5
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 1
• Exact Mass: 298.04773803
• Heavy Atom Count: 22
• Complexity: 454

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=C(C2=C(C=C1O)OC3=C(C2=O)C4=CC=CC=C4O3)O