Basic information
- Standard SMILES
CCOC(=O)C(C(=O)OCC)C(C)Cl- InChIKey
PVQAPCGEEOAXNQ-UHFFFAOYSA-N- Molecular formula
- C9H15ClO4
- Average molar mass
- 222.66 g/mol
- Monoisotopic mass
- 222.0658866
Names & identifiers
- IUPAC
- diethyl 2-(1-chloroethyl)propanedioate
Database identifiers
- PubChem CID
- 85635534
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 187
Related reactions
2 records
Linked notes
Loading…