5-Oxo-2H,5H-[1]benzopyrano[4,3-b][1,4]oxazine-3-carboxylic acid

Base Information

• Chemical Name: 5-Oxo-2H,5H-[1]benzopyrano[4,3-b][1,4]oxazine-3-carboxylic acid
• CAS No.: 87073-31-2
• Molecular Formula: C12H7NO5
• DSSTox Substance ID: DTXSID10540482
• Wikidata: Q82416511

Synonyms:87073-31-2;DTXSID10540482;5-Oxo-2H,5H-[1]benzopyrano[4,3-b][1,4]oxazine-3-carboxylic acid

Chemical Property of 5-Oxo-2H,5H-[1]benzopyrano[4,3-b][1,4]oxazine-3-carboxylic acid

Chemical Property:

• XLogP3: 1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 1
• Exact Mass: 245.03242232
• Heavy Atom Count: 18
• Complexity: 479

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1C(=NC2=C(O1)C3=CC=CC=C3OC2=O)C(=O)O

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