2,4-Dioxopentanedioic acid
Basic information
- CAS
139602-06-5- Standard SMILES
O=C(O)C(=O)CC(=O)C(=O)O- InChIKey
TVKBBTQJNQDZRU-UHFFFAOYSA-N- Molecular formula
- C5H4O6
- Average molar mass
- 160.08 g/mol
- Monoisotopic mass
- 160.00078784
Overview
2,4-dioxopentanedioic acid is an oxodicarboxylic acid that is glutaric acid which is substituted by oxo groups at positions 2 and 4. It is an oxo dicarboxylic acid and a beta-diketone.
Names & identifiers
- Preferred name
- 2,4-Dioxopentanedioic acid
- IUPAC
- 2,4-dioxopentanedioic acid
Names & synonyms
2,4-dioxopentanedioic acidCHEBI:42056RefChem:935330139602-06-52,4-DIOXO-PENTANEDIOIC ACIDPentanedioic acid, 2,4-dioxo-diketoglutaric acid2,4-dioxoglutaric acid2,4-dioxopentanedioicacidDHDSCHEMBL292473DTXSID10332167
Show more names
Q27104488
Database identifiers
- CAS
139602-06-5- PubChem CID
- 444873
- DTXSID
DTXSID10332167- ChEBI
CHEBI:42056- Nikkaji
- J282.089G
Properties
Computed structural properties
- XLogP
- -0.8
- Topological polar surface area
- 109 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 203
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…