Basic information
- Standard SMILES
CCOC(=O)CC(O)C(CC(C)C)C(=O)OCC- InChIKey
AWLQQGSPKJGJEI-UHFFFAOYSA-N- Molecular formula
- C13H24O5
- Average molar mass
- 260.33 g/mol
Names & identifiers
- Preferred name
- Diethyl 3-hydroxy-2-(2-methylpropyl)pentanedioate
- IUPAC
- diethyl 3-hydroxy-2-(2-methylpropyl)pentanedioate
Names & synonyms
Diethyl 3-hydroxy-2-(2-methylpropyl)pentanedioateSCHEMBL5141941AWLQQGSPKJGJEI-UHFFFAOYSA-NDiethyl 3-hydroxy-2(2-methylpropyl)pentanedioate
Database identifiers
- PubChem CID
- 10377906
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 72.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 10
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 262
Related reactions
3 records
Compound notes
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