Completing data — refresh the page later to see the latest
Basic information
- Standard SMILES
CCOC(=O)C(=Cc1ccc2c(c1)OCO2)c1ccccc1- InChIKey
FNAJCZZMYFOYOU-UHFFFAOYSA-N- Molecular formula
- C18H16O4
- Average molar mass
- 296.3 g/mol
- Monoisotopic mass
- 296.10485899
Names & identifiers
- Preferred name
- Ethyl 3-(1,3-benzodioxol-5-yl)-2-phenylprop-2-enoate
- IUPAC
- ethyl 3-(1,3-benzodioxol-5-yl)-2-phenylprop-2-enoate
Names & synonyms
MLS002638374CHEMBL1729243HMS3087C24SMR001547860
Database identifiers
- PubChem CID
- 225201
- ChEMBL
CHEMBL1729243
Properties
Computed structural propertiesFilling in
- XLogP
- 4.1
- Topological polar surface area
- 44.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 411
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…