4-Ethoxy-7-methoxycoumarin
Basic information
- CAS
29064-32-2- Standard SMILES
CCOc1cc(=O)oc2cc(OC)ccc12- InChIKey
DXYREIQSILTYNR-UHFFFAOYSA-N- Molecular formula
- C12H12O4
- Average molar mass
- 220.22 g/mol
- Monoisotopic mass
- 220.07355886
Names & identifiers
- Preferred name
- 4-Ethoxy-7-methoxycoumarin
- IUPAC
- 4-ethoxy-7-methoxychromen-2-one
- English name
- 4-ETHOXY-7-METHOXYCOUMARIN
- Molecular formula
- C12H12O4
- Molecular weight
- 220.22
Names & synonyms
4-ETHOXY-7-METHOXYCOUMARIN4-ethoxy-7-methoxychromen-2-one29064-32-2ST060209DXYREIQSILTYNR-UHFFFAOYSA-NDTXSID701372508AKOS024283077
Database identifiers
- CAS
29064-32-2- PubChem CID
- 688787
- DTXSID
DTXSID701372508
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 44.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 297
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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