Basic information
- Standard SMILES
COC(=O)c1ccc(OCC(C)=O)cc1C(=O)OC- InChIKey
FQYPFXLWUHBFAL-UHFFFAOYSA-N- Molecular formula
- C13H14O6
- Average molar mass
- 266.25 g/mol
Names & identifiers
- Preferred name
- Dimethyl 4-(2-oxopropoxy)phthalate
- IUPAC
- dimethyl 4-(2-oxopropoxy)benzene-1,2-dicarboxylate
Names & synonyms
SCHEMBL8405878FQYPFXLWUHBFAL-UHFFFAOYSA-Ndimethyl 4-(2-oxopropoxy)phthalate
Database identifiers
- PubChem CID
- 21832192
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 78.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 351
Related reactions
3 records
Compound notes
Loading…