7-Methoxy-3-oxatricyclo[7.3.1.05,13]trideca-1(12),5(13),6,8,10-pentaene-2,4-dione

Base Information

• Chemical Name: 7-Methoxy-3-oxatricyclo[7.3.1.05,13]trideca-1(12),5(13),6,8,10-pentaene-2,4-dione
• CAS No.: 5289-78-1
• Molecular Formula: C₁₃H₈O₄
• Molecular Weight: 228.204
• DSSTox Substance ID: DTXSID801245758
• Nikkaji Number: J2.307.277G
• Mol file: 5289-78-1.mol

Synonyms:5289-78-1;SCHEMBL7709415;DTXSID801245758;5-Methoxy-1H,3H-naphtho[1,8-cd]pyran-1,3-dione

Chemical Property of 7-Methoxy-3-oxatricyclo[7.3.1.05,13]trideca-1(12),5(13),6,8,10-pentaene-2,4-dione

Chemical Property:

• XLogP3: 2.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 228.04225873
• Heavy Atom Count: 17
• Complexity: 351

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: COC1=CC2=C3C(=C1)C=CC=C3C(=O)OC2=O