Basic information
- Standard SMILES
CC(C)(C)OC(=O)N1CCC(C(=O)O)[C@H]1C(=O)O- InChIKey
DYMWLRVGPQDELA-MLWJPKLSSA-N- Molecular formula
- C11H17NO6
- Average molar mass
- 259.26 g/mol
- Monoisotopic mass
- 259.10558726
Names & identifiers
- Preferred name
- 3-carboxy-N-boc-proline
- IUPAC
- (2S)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2,3-dicarboxylic acid
Names & synonyms
3-carboxy-N-boc-prolineSCHEMBL1943660DYMWLRVGPQDELA-MLWJPKLSSA-N
Database identifiers
- PubChem CID
- 67220720
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 104 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 372
Related reactions
2 records
Compound notes
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