4-Methyl-2-oxo-2H-1-benzopyran-5,7-diyl dimethanesulfonate

Base Information

• Chemical Name: 4-Methyl-2-oxo-2H-1-benzopyran-5,7-diyl dimethanesulfonate
• CAS No.: 62113-96-6
• Molecular Formula: C12H12O8S2
• DSSTox Substance ID: DTXSID50494410
• Wikidata: Q82341746

Synonyms:62113-96-6;DTXSID50494410;4-Methyl-2-oxo-2H-1-benzopyran-5,7-diyl dimethanesulfonate

Chemical Property of 4-Methyl-2-oxo-2H-1-benzopyran-5,7-diyl dimethanesulfonate

Chemical Property:

• XLogP3: 0.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 4
• Exact Mass: 347.99735968
• Heavy Atom Count: 22
• Complexity: 680

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC(=O)OC2=C1C(=CC(=C2)OS(=O)(=O)C)OS(=O)(=O)C

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