Methyl 4-(2-(2,4-dihydroxyphenyl)-2-oxoethyl)-3-fluorobenzoate
Completing data — refresh the page later to see the latest
Basic information
- Standard SMILES
COC(=O)c1ccc(CC(=O)c2ccc(O)cc2O)c(F)c1- InChIKey
VHDUFFDNWZALIQ-UHFFFAOYSA-N- Molecular formula
- C16H13FO5
- Average molar mass
- 304.27 g/mol
Names & identifiers
- Preferred name
- Methyl 4-(2-(2,4-dihydroxyphenyl)-2-oxoethyl)-3-fluorobenzoate
- IUPAC
- methyl 4-[2-(2,4-dihydroxyphenyl)-2-oxoethyl]-3-fluorobenzoate
Names & synonyms
SCHEMBL2332991VHDUFFDNWZALIQ-UHFFFAOYSA-Nmethyl 4-(2-(2,4-dihydroxyphenyl)-2-oxoethyl)-3-fluorobenzoate
Database identifiers
- PubChem CID
- 67367178
Properties
Computed structural propertiesFilling in
- XLogP
- 3
- Topological polar surface area
- 83.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 413
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
2 records
Compound notes
Loading…