Methyl 7-(carbamoyloxy)-2-oxo-2H-1-benzopyran-6-carboxylate
Basic information
- CAS
60432-40-8- Standard SMILES
COC(=O)c1cc2ccc(=O)oc2cc1OC(N)=O- InChIKey
GAYYJCHFHXFYMN-UHFFFAOYSA-N- Molecular formula
- C12H9NO6
- Average molar mass
- 263.2 g/mol
- Monoisotopic mass
- 263.04298701
Names & identifiers
- Preferred name
- Methyl 7-(carbamoyloxy)-2-oxo-2H-1-benzopyran-6-carboxylate
- IUPAC
- methyl 7-carbamoyloxy-2-oxochromene-6-carboxylate
Names & synonyms
60432-40-8NSC280604DTXSID50314068Methyl 7-(carbamoyloxy)-2-oxo-2H-1-benzopyran-6-carboxylateNSC-280604DS-011465methyl 7-carbamoyloxy-2-oxo-chromene-6-carboxylate
Database identifiers
- CAS
60432-40-8- PubChem CID
- 322544
- DTXSID
DTXSID50314068
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 105 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 432
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Compound notes
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