Basic information
- CAS
653589-42-5- Standard SMILES
CC(C)(C)OC(=O)[C@@H]1C=CCCN1C(=O)OC(C)(C)C- InChIKey
YCVAAPUQRFFJDS-NSHDSACASA-N- Molecular formula
- C15H25NO4
- Average molar mass
- 283.36 g/mol
- Monoisotopic mass
- 283.17835828
Names & identifiers
- Preferred name
- Pipecolate derivative
- IUPAC
- ditert-butyl (6S)-3,6-dihydro-2H-pyridine-1,6-dicarboxylate
Names & synonyms
pipecolate derivativeDTXSID601147354Di-tert-butyl (2S)-5,6-dihydropyridine-1,2(2H)-dicarboxylate1,2-Bis(1,1-dimethylethyl) (2S)-5,6-dihydro-1,2(2H)-pyridinedicarboxylate653589-42-5
Database identifiers
- CAS
653589-42-5- PubChem CID
- 91982966
- DTXSID
DTXSID601147354
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 55.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 401
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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