Basic information
- CAS
7487-65-2- Standard SMILES
CCOC(=O)CO.CCOC(=O)c1ccccc1C(=O)OCC- InChIKey
ROROTJZMWFURIA-UHFFFAOYSA-N- Molecular formula
- C16H22O7
- Average molar mass
- 326.34 g/mol
- Monoisotopic mass
- 326.13655304
Names & identifiers
- Preferred name
- Diethyl benzene-1,2-dicarboxylate; ethyl 2-hydroxyacetate
- IUPAC
- diethyl benzene-1,2-dicarboxylate;ethyl 2-hydroxyacetate
Names & synonyms
diethyl benzene-1,2-dicarboxylate; ethyl 2-hydroxyacetateDTXSID502747597487-65-2RefChem:1083493DTXCID90226217SCHEMBL4834753Diethyl benzene-1,2-dicarboxylate--ethyl hydroxyacetate (1/1)
Database identifiers
- CAS
7487-65-2- PubChem CID
- 24079
- DTXSID
DTXSID50274759
Properties
Computed structural properties
- Topological polar surface area
- 99.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 9
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 283
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…