Basic information
- Standard SMILES
COC(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1Cl- InChIKey
XHKZNKWJHCUWMC-ZDUSSCGKSA-N- Molecular formula
- C15H18ClNO4
- Average molar mass
- 311.76 g/mol
- Monoisotopic mass
- 311.0924357
Names & identifiers
- Preferred name
- (S)-1-(2-Chlorobenzyloxycarbonyl)-piperidine-2-carboxylic acid methyl ester
- IUPAC
- 1-O-[(2-chlorophenyl)methyl] 2-O-methyl (2S)-piperidine-1,2-dicarboxylate
Names & synonyms
SCHEMBL5965383XHKZNKWJHCUWMC-ZDUSSCGKSA-N(S)-1-(2 Chlorobenzyloxycarbonyl)-piperidine-2-carboxylic acid methyl ester(S)-1-(2-Chlorobenzyloxycarbonyl)-piperidine-2-carboxylic acid methyl ester
Database identifiers
- PubChem CID
- 58635231
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 55.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 377
Related reactions
1 records
Compound notes
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