Basic information
- Standard SMILES
CCOC(=O)C1COc2cc(CC)ccc2O1- InChIKey
OSORYGCAOADBEC-UHFFFAOYSA-N- Molecular formula
- C13H16O4
- Average molar mass
- 236.26 g/mol
Names & identifiers
- Preferred name
- Ethyl 6-ethyl-2,3-dihydro-1,4-benzodioxin-2-carboxylate
- IUPAC
- ethyl 6-ethyl-2,3-dihydro-1,4-benzodioxine-2-carboxylate
Names & synonyms
SCHEMBL9255724OSORYGCAOADBEC-UHFFFAOYSA-NEthyl 6-ethyl-2,3-dihydro-1,4-benzodioxin-2-carboxylate
Database identifiers
- PubChem CID
- 15210220
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 44.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 266
Related reactions
5 records
Compound notes
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