2H-1-Benzopyran-3-carboxylic acid, 5,7-dimethoxy-2-oxo-

Base Information

• Chemical Name: 2H-1-Benzopyran-3-carboxylic acid, 5,7-dimethoxy-2-oxo-
• CAS No.: 81017-27-8
• Molecular Formula: C12H10O6
• Molecular Weight: 250.208
• NSC Number: 746848
• DSSTox Substance ID: DTXSID40437578
• Nikkaji Number: J983.495H

Synonyms:81017-27-8;2H-1-Benzopyran-3-carboxylic acid, 5,7-dimethoxy-2-oxo-;5,7-Dimethoxy-2-oxo-2H-1-benzopyran-3-carboxylic acid;5,7-dimethoxy-2-oxochromene-3-carboxylic acid;SCHEMBL11261487;DTXSID40437578;NSC746848;NSC-746848;2-Oxo-5,7-dimethoxy-2H-1-benzopyran-3-carboxylic acid;2H-1-Benzopyran-3-carboxylic acid,7-dimethoxy-2-oxo-

Chemical Property of 2H-1-Benzopyran-3-carboxylic acid, 5,7-dimethoxy-2-oxo-

Chemical Property:

• PSA: 85.97000
• LogP: 1.50840
• XLogP3: 2.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 3
• Exact Mass: 250.04773803
• Heavy Atom Count: 18
• Complexity: 388

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC2=C(C=C(C(=O)O2)C(=O)O)C(=C1)OC

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