3-Quinuclidinone hydrochloride
- Iupac Name：1-azabicyclo[2.2.2]octan-3-one;hydrochloride
- CAS No.: 1193-65-3
- Molecular Weight：161.63
- Modify Date.: 2022-12-06 15:54
1. Names and Identifiers
- 1.1 Name
- 3-Quinuclidinone hydrochloride
- 1.2 Synonyms
1-AZA-3-OXOBICYCLO[2.2.2]OCTANE HYDROCHLORIDE 1-AZABICYCLO[2.2.2]OCTAN-3-ONE HYDROCHLORIDE 3-AMINOQUINUCLIDINONE HYDROCHLORIDE 3-QUINUCLIDINONE HCL 3-quinuclidinone hydrochloride (solina new impurity) 3-QUINUCLIDONE HYDROCHLORIDE QUINUCLIDIN-3-ONE HYDROCHLORIDE
- 1.3 CAS No.
- 1193-65-3
- 1.4 EINECS(EC#)
- 214-776-5
- 1.5 Molecular Formula
- C7H12ClNO (isomer)
- 1.6 Inchi
- InChI=1/C7H11NO.ClH/c9-7-5-8-3-1-6(7)2-4-8;/h6H,1-5H2;1H
- 1.7 InChkey
- RFDPHKHXPMDJJD-UHFFFAOYNA-N
- 1.8 Canonical Smiles
- Cl.[H][C@]12CCN(CC1)CC2=O
- 1.9 Isomers Smiles
- C1CN2CCC1C(=O)C2.Cl
2. Properties
- 2.1 Melting point
- >300?°C (dec.)(lit.)
- 2.1 StorageTemp
- Inert atmosphere,Room Temperature
3. Safety and Handling
- 3.1 Hazard Codes
- Xi
- 3.1 Risk Statements
- 36/37/38
- 3.1 Safety Statements
- 22-24/25-37/39-26
- 3.1 WGK Germany
- 3
4. MSDS
2.Hazard identification
2.1 Classification of the substance or mixture
Not classified.
2.2 GHS label elements, including precautionary statements
| Pictogram(s) |  |
| Signal word | Warning |
| Hazard statement(s) | H315 Causes skin irritation H319 Causes serious eye irritation H335 May cause respiratory irritation |
| Precautionary statement(s) | |
| Prevention | none |
| Response | none |
| Storage | none |
| Disposal | none |
2.3 Other hazards which do not result in classification
none
6. Synthesis Route
1193-65-3Total: 4 Synthesis Route
7. Other Information
- 7.0 BRN
- 3695039
- 7.1 Uses
- 3-Quinuclidinone Hydrochloride is used in the synthesis of cevimeline, a thiolating agent. Also used in the preparation of novel CB1 and CB2 cannabinoid receptor ligands.
- 7.2 Chemical Properties
- white to off-white powder
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9. Realated Product Infomation
![2-[(4-FLUOROPHENYL)METHYLENE]-3-QUINUCLIDINONE](https://structimg.guidechem.com/4/40/733119.png)
![2-[(4-NITROPHENYL)METHYLENE]-3-QUINUCLIDINONE](https://structimg.guidechem.com/5/29/540748.png)
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