≥99% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Room temperature,Argon charged Ships Normal Check lot-specific COA for exact specifications.
SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
Cited in 3 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
| Pubchem Sid | 504756505 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/504756505 |
| Sonrisas canónicas | C1CN2CCC1C(=O)C2.Cl |
| IUPAC Name | 1-azabicyclo[2.2.2]octan-3-one;hydrochloride |
| InChIKey | RFDPHKHXPMDJJD-UHFFFAOYSA-N |
| INCHI | 1S/C7H11NO.ClH/c9-7-5-8-3-1-6(7)2-4-8;/h6H,1-5H2;1H |
| Isómeros SMILES | C1CN2CCC1C(=O)C2.Cl |
| WGK Alemania | 3 |
| PubChem CID | 102019 |
| Peso molecular | 161.63 |
| Beilstein | 3695039 |
| Reaxy-Rn | 3695039 |
Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS →Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA →Full quality attributes and acceptance criteria for this grade.
View spec sheet →Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Organoheterocyclic compounds |
| Clase | Quinuclidines |
| Subclass | Quinuclidones |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Quinuclidones |
| Alternative Parents | Piperidinones Trialkylamines Ketones Azacyclic compounds Organopnictogen compounds Organic oxides Hydrochlorides Hydrocarbon derivatives |
| Molecular Framework | Aliphatic heteropolycyclic compounds |
| Substituents | Quinuclidone - Piperidinone - Piperidine - Ketone - Tertiary amine - Tertiary aliphatic amine - Azacycle - Amine - Hydrochloride - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Carbonyl group - Aliphatic heteropolycyclic compound |
| Descripción | This compound belongs to the class of organic compounds known as quinuclidones. These are compounds containing a quinuclidine moiety which bears a ketone group. |
| External Descriptors | Not available |
| Activity Type | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
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| Activity Type | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
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Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Fecha | Articulo |
|---|---|---|---|
 E2618433 | Certificate of Analysis | May 07, 2026 | Q109701 |
| E2618432 | Certificate of Analysis | May 07, 2026 | Q109701 |
| E2618362 | Certificate of Analysis | May 07, 2026 | Q109701 |
| I2523603 | Certificate of Analysis | Sep 06, 2025 | Q109701 |
| I2523602 | Certificate of Analysis | Sep 06, 2025 | Q109701 |
| I2523601 | Certificate of Analysis | Sep 06, 2025 | Q109701 |
| E2514595 | Certificate of Analysis | Mar 19, 2025 | Q109701 |
| E2514594 | Certificate of Analysis | Mar 19, 2025 | Q109701 |
| E2514576 | Certificate of Analysis | Mar 19, 2025 | Q109701 |
| K2415417 | Certificate of Analysis | Oct 24, 2024 | Q109701 |
| K2415416 | Certificate of Analysis | Oct 24, 2024 | Q109701 |
| D2416473 | Certificate of Analysis | Mar 13, 2024 | Q109701 |
| D2416472 | Certificate of Analysis | Mar 13, 2024 | Q109701 |
| D2416471 | Certificate of Analysis | Mar 13, 2024 | Q109701 |
| D2416470 | Certificate of Analysis | Mar 13, 2024 | Q109701 |
| D2416469 | Certificate of Analysis | Mar 13, 2024 | Q109701 |
| C2401487 | Certificate of Analysis | Feb 19, 2024 | Q109701 |
| C2401486 | Certificate of Analysis | Feb 19, 2024 | Q109701 |
| C2401485 | Certificate of Analysis | Feb 19, 2024 | Q109701 |
| C2401484 | Certificate of Analysis | Feb 19, 2024 | Q109701 |
| D1607190 | Certificate of Analysis | Jan 19, 2024 | Q109701 |
| J2317116 | Certificate of Analysis | May 21, 2021 | Q109701 |
| Sensibilidad | Hygroscopic. |
|---|---|
| Punto de fusión (°C) | >300°C |
| Peso molecular | 161.630 g/mol |
| XLogP3 | |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 0 |
| Exact Mass | 161.061 Da |
| Monoisotopic Mass | 161.061 Da |
| Topological Polar Surface Area | 20.300 Ų |
| Heavy Atom Count | 10 |
| Formal Charge | 0 |
| Complexity | 136.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 2 |
| 1. Yantao Dong, Wei Xu, Xue Lan, Hongsheng Mo, Xiaozheng Lan, Jiandang Liu, Bangjiao Ye, Hongjun Zhang. (2023) Lithium-Ion and Chloride-Ion Transfer in Chiral and Racemic 3-Hydroxyquinuclidinium Perchlorate: Influence of Defects and a Mixed Plastic Crystal Matrix. Journal of Physical Chemistry C, [PMID:] [10.1021/acs.jpcc.2c07928] |
| 2. Xue Lan, Xin Wang, Dong Xue Zhang, Tiancheng Mu, Xiao Zheng Lan. (2021) Cation and Anion Transfer in Quinuclidinium Hexafluorophosphate Plastic Crystal: Role of Constituent Ions and the Crystalline Structure. Journal of Physical Chemistry C, [PMID:] [10.1021/acs.jpcc.1c05891] |
| 3. Mingan Yu, Duqiang Liu, Lili Sun, Jing Li, Qian Chen, Lijun Pan, Jingchuan Shang, Shurong Zhang, Wei Li. (2017) Facile fabrication of 3D porous hybrid sphere by co-immobilization of multi-enzyme directly from cell lysates as an efficient and recyclable biocatalyst for asymmetric reduction with coenzyme regeneration in situ. INTERNATIONAL JOURNAL OF BIOLOGICAL MACROMOLECULES, [PMID:28526345] [10.1016/j.ijbiomac.2017.05.080] |
