Basic information
- Standard SMILES
CCOC(=O)CCCCOc1ccc2oc(=O)ccc2c1- InChIKey
JGTRRADGRNKTTR-UHFFFAOYSA-N- Molecular formula
- C16H18O5
- Average molar mass
- 290.31 g/mol
Names & identifiers
- Preferred name
- 6-(4-Ethoxycarbonylbutyl)oxycoumarin
- IUPAC
- ethyl 5-(2-oxochromen-6-yl)oxypentanoate
Names & synonyms
SCHEMBL8416505JGTRRADGRNKTTR-UHFFFAOYSA-N6-(4-ethoxycarbonylbutyl)oxycoumarin
Database identifiers
- PubChem CID
- 15029696
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 61.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 8
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 390
Related reactions
10 records
Compound notes
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