Ethyl 2,5-dioxopiperazine-1-carboxylate
Basic information
- CAS
143411-83-0- Standard SMILES
CCOC(=O)N1CC(=O)NCC1=O- InChIKey
JHWIPPPKKUVBHA-UHFFFAOYSA-N- Molecular formula
- C7H10N2O4
- Average molar mass
- 186.17 g/mol
- Monoisotopic mass
- 186.0640568
Names & identifiers
- Preferred name
- Ethyl 2,5-dioxopiperazine-1-carboxylate
- IUPAC
- ethyl 2,5-dioxopiperazine-1-carboxylate
- English name
- 1-Piperazinecarboxylicacid,2,5-dioxo-,ethylester(9CI)
- Molecular formula
- C7H10N2O4
- Molecular weight
- 186.17
Names & synonyms
143411-83-0ETHYL 2,5-DIOXOPIPERAZINE-1-CARBOXYLATE1-Piperazinecarboxylicacid,2,5-dioxo-,ethylester(9CI)SCHEMBL9181473DTXSID306011601-Piperazinecarboxylic acid, 2,5-dioxo-, ethyl ester
Database identifiers
- CAS
143411-83-0- PubChem CID
- 19902956
- DTXSID
DTXSID30601160
Properties
Computed structural properties
- XLogP
- -0.6
- Topological polar surface area
- 75.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 251
Physicochemical properties
- Boiling point
- 486 · 486.0±38.0 °C(Predicted)
- Density
- 1.323 · 1.323±0.06 g/cm3(Predicted)
- pka
- 12.91 · 12.91±0.20(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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