Basic information
- Standard SMILES
CCCCC(C=O)CC.OCC(O)CO- InChIKey
KVFKZOPMAYYZTK-UHFFFAOYSA-N- Molecular formula
- C11H24O4
- Average molar mass
- 220.31 g/mol
Names & identifiers
- Preferred name
- 2-Ethylhexanal Glycerol
- IUPAC
- 2-ethylhexanal;propane-1,2,3-triol
Names & synonyms
2-Ethylhexanal GlycerolSCHEMBL2064357KVFKZOPMAYYZTK-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 86639486
Properties
Computed structural properties
- Topological polar surface area
- 77.8 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 94.2
Related reactions
1 records
Compound notes
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