(2S,6R)-6-(hydroxymethyl)piperidine-2-carboxylic acid
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Basic information
- CAS
692255-19-9- Standard SMILES
O=C(O)[C@@H]1CCC[C@H](CO)N1- InChIKey
OIHIUNWHKBRWJW-RITPCOANSA-N- Molecular formula
- C7H13NO3
- Average molar mass
- 159.18 g/mol
- Monoisotopic mass
- 159.08954328
Names & identifiers
- Preferred name
- (2S,6R)-6-(hydroxymethyl)piperidine-2-carboxylic acid
- IUPAC
- (2S,6R)-6-(hydroxymethyl)piperidine-2-carboxylic acid
- English name
- 2-Piperidinecarboxylicacid,6-(hydroxymethyl)-,(2S,6R)-(9CI)
- Molecular formula
- C7H13NO3
- Molecular weight
- 159.18
Names & synonyms
692255-19-9(2s,6r)-6-hydroxymethyl pipecolic acid2-Piperidinecarboxylic acid, 6-(hydroxymethyl)-, (2S,6R)-2-Piperidinecarboxylicacid,6-(hydroxymethyl)-,(2S,6R)-(9CI)
Database identifiers
- CAS
692255-19-9- PubChem CID
- 10986524
Properties
Computed structural propertiesFilling in
- XLogP
- -2.6
- Topological polar surface area
- 69.6 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 149
Physicochemical properties
- Boiling point
- 343.8 · 343.8±32.0 °C(Predicted)
- Density
- 1.194 · 1.194±0.06 g/cm3(Predicted)
- pka
- 2.38 · 2.38±0.40(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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