Basic information
- CAS
88917-26-4- Standard SMILES
O=C(O)CC(O)(CC(=O)OOO)C(=O)O- InChIKey
VHBCVGYGQGLNJG-UHFFFAOYSA-N- Molecular formula
- C6H8O9
- Average molar mass
- 224.12 g/mol
Names & identifiers
- Preferred name
- 2-Hydroxy-2-[2-oxo-2-(trioxidanyl)ethyl]butanedioic acid
- IUPAC
- 2-hydroxy-2-[2-oxo-2-(trioxidanyl)ethyl]butanedioic acid
- English name
- Oxo alcohol citrate
- Molecular weight
- 0
Names & synonyms
Oxo alcohol citrate
Database identifiers
- CAS
88917-26-4
Properties
Computed structural properties
- XLogP
- -1.8
- Topological polar surface area
- 151 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 7
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 272
Physicochemical properties
- EPA Substance Registry System
- 1 · 1,2,3-Propanetricarboxylic acid, 2-hydroxy-, triesters with high-boiling C6-10-alkene hydroformylation products (88917-26-4)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- tsca
- TSCA listed
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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