Basic information
- CAS
761362-88-3- Standard SMILES
OC[C@H]1O[C@@H](N2CCCCC2)[C@H](O)[C@H]1O- InChIKey
ZKAUOGATHKJTLF-UTINFBMNSA-N- Molecular formula
- C10H19NO4
- Average molar mass
- 217.26 g/mol
Names & identifiers
- Preferred name
- (2R,3R,4R,5R)-2-(hydroxymethyl)-5-piperidin-1-yloxolane-3,4-diol
- IUPAC
- (2R,3R,4R,5R)-2-(hydroxymethyl)-5-piperidin-1-yloxolane-3,4-diol
- English name
- Piperidine, 1-ba-D-xylofuranosyl- (9CI)
- Molecular formula
- C10H19NO4
- Molecular weight
- 217.26216
Names & synonyms
Piperidine, 1-bPiperidine, 1-β-D-xylofuranosyl-Piperidine,1-bta-D-xylofuranosyl-(9CI)Piperidine, 1-ba-D-xylofuranosyl- (9CI)
Database identifiers
- CAS
761362-88-3
Properties
Computed structural properties
- XLogP
- -0.4
- Topological polar surface area
- 73.2 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 208
Physicochemical properties
- Boiling point
- 417.4 · 417.4±45.0 °C(Predicted)
- Density
- 1.329 · 1.329±0.06 g/cm3(Predicted)
- pka
- 13.62 · 13.62±0.70(Predicted)
Chemistry & industry
Suppliers2 total
CHEMSTEP[email protected]
凯方医药科技有限公司—
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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