Basic information
- Standard SMILES
COc1cc(C=O)c(F)c2c1OCOC2- InChIKey
ABECJLWQKBPVGW-UHFFFAOYSA-N- Molecular formula
- C10H9FO4
- Average molar mass
- 212.17 g/mol
Names & identifiers
- Preferred name
- 5-fluoro-8-methoxy-4H-benzo[1,3]dioxine-6-carbaldehyde
- IUPAC
- 5-fluoro-8-methoxy-4H-1,3-benzodioxine-6-carbaldehyde
Names & synonyms
SCHEMBL1620156ABECJLWQKBPVGW-UHFFFAOYSA-N5-fluoro-8-methoxy-4H-benzo[1,3]dioxine-6-carbaldehyde
Database identifiers
- PubChem CID
- 59516817
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 44.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 235
Related reactions
7 records
Compound notes
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