Basic information
- CAS
57352-24-6- Standard SMILES
CCCCCCOC(=O)C1CCC(=O)N1- InChIKey
IHPADOUYLWBQEN-UHFFFAOYSA-N- Molecular formula
- C11H19NO3
- Average molar mass
- 213.27 g/mol
- Monoisotopic mass
- 213.13649347
Names & identifiers
- Preferred name
- Hexyl 5-oxo-L-prolinate
- IUPAC
- hexyl 5-oxopyrrolidine-2-carboxylate
Names & synonyms
Hexyl 5-oxo-L-prolinate57352-24-6SCHEMBL3326274DTXSID80972857IHPADOUYLWBQEN-UHFFFAOYSA-NEINECS 260-689-0Hexyl 5-hydroxy-3,4-dihydro-2H-pyrrole-2-carboxylate
Database identifiers
- CAS
57352-24-6- PubChem CID
- 93641
- DTXSID
DTXSID80972857- EC Number
- 260-689-0
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 55.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 228
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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