4H-1-Benzopyran-2-carboxamide, 5,7-dimethyl-4-oxo-
Basic information
- CAS
33544-04-6- Standard SMILES
Cc1cc(C)c2c(=O)cc(C(N)=O)oc2c1- InChIKey
UTAURGNFTNUWCZ-UHFFFAOYSA-N- Molecular formula
- C12H11NO3
- Average molar mass
- 217.22 g/mol
- Monoisotopic mass
- 217.07389321
Names & identifiers
- Preferred name
- 4H-1-Benzopyran-2-carboxamide, 5,7-dimethyl-4-oxo-
- IUPAC
- 5,7-dimethyl-4-oxochromene-2-carboxamide
Names & synonyms
5,7-dimethyl-4-oxo-4h-chromene-2-carboxamide4H-1-Benzopyran-2-carboxamide, 5,7-dimethyl-4-oxo-5464-18-633544-04-65,7-Dimethyl-4-oxo-4H-1-benzopyran-2-carboxamideBRN 1376984DTXSID70187216
Database identifiers
- CAS
33544-04-6- PubChem CID
- 214629
- DTXSID
DTXSID70187216
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 69.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 361
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Compound notes
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