2H-1-Benzopyran-2-one, 7-(acetyloxy)-8-iodo-

Base Information

• Chemical Name: 2H-1-Benzopyran-2-one, 7-(acetyloxy)-8-iodo-
• CAS No.: 112699-36-2
• Molecular Formula: C11H7IO4
• Molecular Weight: 330.079
• DSSTox Substance ID: DTXSID40459972
• Nikkaji Number: J2.162.862J
• Wikidata: Q82283868
• Mol file: 112699-36-2.mol

Synonyms:112699-36-2;2H-1-Benzopyran-2-one, 7-(acetyloxy)-8-iodo-;7-acetoxy-8-iodocoumarin;DTXSID40459972;Acetic acid 2-oxo-8-iodo-2H-1-benzopyran-7-yl ester

Chemical Property of 2H-1-Benzopyran-2-one, 7-(acetyloxy)-8-iodo-

Chemical Property:

• XLogP3: 2.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 329.93891
• Heavy Atom Count: 16
• Complexity: 339

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC(=O)OC1=C(C2=C(C=C1)C=CC(=O)O2)I