2,3-Piperazinedicarboxylic acid
Basic information
- CAS
89601-09-2- Standard SMILES
O=C(O)C1NCCNC1C(=O)O- InChIKey
ZLSOKZQPVJYNKB-UHFFFAOYSA-N- Molecular formula
- C6H10N2O4
- Average molar mass
- 174.15 g/mol
- Monoisotopic mass
- 174.0640568
Names & identifiers
- Preferred name
- 2,3-Piperazinedicarboxylic acid
- IUPAC
- piperazine-2,3-dicarboxylic acid
- English name
- 2,3-Piperazinedicarboxylicacid(6CI,7CI,9CI)
- Molecular formula
- C6H10N2O4
- Molecular weight
- 0
Names & synonyms
Piperazine-2,3-dicarboxylic acid2,3-Piperazinedicarboxylic acid89601-09-2NSC133397SCHEMBL2806369ZLSOKZQPVJYNKB-UHFFFAOYSA-NDTXSID801008893AKOS006286181NSC-1333972,3-Piperazinedicarboxylicacid(6CI,7CI,9CI)
Database identifiers
- CAS
89601-09-2- PubChem CID
- 280973
- DTXSID
DTXSID801008893
Properties
Computed structural properties
- XLogP
- -6.2
- Topological polar surface area
- 98.7 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 184
Related reactions
5 records
Compound notes
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