Basic information
- Standard SMILES
COC(=O)C(=O)c1ccc(OC2CCOC2)cc1- InChIKey
CLKNNHRMWYPHJN-UHFFFAOYSA-N- Molecular formula
- C13H14O5
- Average molar mass
- 250.25 g/mol
Names & identifiers
- Preferred name
- Methyl 2-[4-[(tetrahydro-3-furanyl)oxy]phenyl]-2-oxoacetate
- IUPAC
- methyl 2-oxo-2-[4-(oxolan-3-yloxy)phenyl]acetate
Names & synonyms
SCHEMBL7385749CLKNNHRMWYPHJN-UHFFFAOYSA-Nmethyl 2-[4-[(tetrahydro-3-furanyl)oxy]-phenyl]-2-oxoacetatemethyl 2-[4-[(tetrahydro-3-furanyl)oxy]phenyl]-2-oxoacetate
Database identifiers
- PubChem CID
- 21844207
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 61.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 307
Related reactions
6 records
Compound notes
Loading…