Basic information
- Standard SMILES
CCOC(=O)CCc1cc(=O)oc2cc(OC)ccc12- InChIKey
DCNGLFUCRAXICM-UHFFFAOYSA-N- Molecular formula
- C15H16O5
- Average molar mass
- 276.28 g/mol
Names & identifiers
- Preferred name
- 4-(2-carbethoxy-1-ethyl)-7-methoxy-2-oxo-2H-1-Benzopyran
- IUPAC
- ethyl 3-(7-methoxy-2-oxochromen-4-yl)propanoate
Names & synonyms
SCHEMBL8324046DCNGLFUCRAXICM-UHFFFAOYSA-N4-(2-carbethoxy-1-ethyl)-7-methoxy-2-oxo-2H-1-Benzopyran
Database identifiers
- PubChem CID
- 86747239
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 61.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 401
Related reactions
2 records
Compound notes
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