Basic information
- CAS
92778-43-3- Standard SMILES
CC(C)COC(=O)C(=O)C(=O)OCC(C)C- InChIKey
KTQZIUYTZLTGJE-UHFFFAOYSA-N- Molecular formula
- C11H18O5
- Average molar mass
- 230.26 g/mol
- Monoisotopic mass
- 230.11542367
Names & identifiers
- Preferred name
- Propanedioic acid, oxo-, bis(2-methylpropyl) ester
- IUPAC
- bis(2-methylpropyl) 2-oxopropanedioate
Names & synonyms
Propanedioic acid, oxo-, bis(2-methylpropyl) ester92778-43-3DTXSID30337871RefChem:374507DTXCID10288958Diisobutyl 2-oxomalonate #Mesoxalic acid, diisobutyl esterSCHEMBL27380746KTQZIUYTZLTGJE-UHFFFAOYSA-NBis(2-methylpropyl) oxopropanedioate
Database identifiers
- CAS
92778-43-3- PubChem CID
- 545202
- DTXSID
DTXSID30337871
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 69.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 8
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 242
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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