Basic information
- CAS
3687-15-8- Standard SMILES
O=C(O)C(=O)C(C(=O)O)C(O)C(=O)O- InChIKey
YILAUJBAPQXZGM-UHFFFAOYSA-N- Molecular formula
- C6H6O8
- Average molar mass
- 206.11 g/mol
- Monoisotopic mass
- 206.00626715
Overview
3-oxalomalic acid is a tricarboxylic acid. It is a conjugate acid of a 3-oxalomalate(3-).
Names & identifiers
- Preferred name
- 3-Oxalomalic acid
- IUPAC
- 1-hydroxy-3-oxopropane-1,2,3-tricarboxylic acid
Names & synonyms
3-Oxalomalic acid1-hydroxy-3-oxopropane-1,2,3-tricarboxylic acidCHEBI:30926RefChem:10683863687-15-8Oxalomalic Acid (sodium salt)oxalomalate89304-26-71-hydroxy-3-oxo-1,2,3-propanetricarboxylic acidOxalomalate (trisodium)Malic acid, 3-oxalo-SCHEMBL321443
Show more names
DTXSID30958065alpha-Hydroxy-beta-oxalosuccinic acid3-Carboxy-3-deoxypent-2-ulosaric acidC01990I81275BRD-A80574334-001-01-9Q271041752B316672-1B4E-4BA1-9347-B0D706846D8E
Database identifiers
- CAS
3687-15-8- PubChem CID
- 439620
- DTXSID
DTXSID30958065- ChEBI
CHEBI:30926- Nikkaji
- J82.430E
Properties
Computed structural properties
- XLogP
- -1.7
- Topological polar surface area
- 149 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 5
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 292
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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