Basic information
- CAS
53251-88-0- Standard SMILES
CC1(C)C2CCC(CCOCCN3CCCCC3)C1C2.O=C(O)CC(O)(CC(=O)O)C(=O)O- InChIKey
SASTVXLBTSKEQG-UHFFFAOYSA-N- Molecular formula
- C24H41NO8
- Average molar mass
- 471.6 g/mol
- Monoisotopic mass
- 471.28321727
Names & identifiers
- Preferred name
- Piperidine, 1-(2-(2-(6,6-dimethyl-2-norpinanyl)ethoxy)ethyl)-, citrate
- IUPAC
- 1-[2-[2-(6,6-dimethyl-2-bicyclo[3.1.1]heptanyl)ethoxy]ethyl]piperidine;2-hydroxypropane-1,2,3-tricarboxylic acid
Names & synonyms
1-(2-(2-(6,6-Dimethyl-2-norpinanyl)ethoxy)ethyl)piperidine citrate53251-88-0Piperidine, 1-(2-(2-(6,6-dimethyl-2-norpinanyl)ethoxy)ethyl)-, citrateRefChem:372942DTXSID909678152-Hydroxypropane-1,2,3-tricarboxylic acid--1-{2-[2-(6,6-dimethylbicyclo[3.1.1]heptan-2-yl)ethoxy]ethyl}piperidine (1/1)
Database identifiers
- CAS
53251-88-0- PubChem CID
- 3040985
- DTXSID
DTXSID90967815
Properties
Computed structural properties
- Topological polar surface area
- 145 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 11
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 536
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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