1,4-Diazabicyclo[3.2.2]nonane structure
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Common Name | 1,4-Diazabicyclo[3.2.2]nonane | ||
|---|---|---|---|---|
| CAS Number | 283-38-5 | Molecular Weight | 126.200 | |
| Density | 1.0±0.1 g/cm3 | Boiling Point | 180.0±8.0 °C at 760 mmHg | |
| Molecular Formula | C7H14N2 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 71.9±9.4 °C | |
Summary: 1,4-diazabicyclo[3.2.2]nonane, also known as 1,4-Diazabicyclo[3.2.2]nonane, has a CAS number of 283-38-5, with a molecular formula of C7H14N2 and a molecular weight of 126.200. It is stored at room temperature and dry. The boiling point is approximately 180.0±8.0 °C. For research-use only, not for medical or clinical usage.
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 1,4-diazabicyclo[3.2.2]nonane |
|---|---|
| Synonym | More Synonyms |
This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.
| Density | 1.0±0.1 g/cm3 |
|---|---|
| Boiling Point | 180.0±8.0 °C at 760 mmHg |
| Molecular Formula | C7H14N2 |
| Molecular Weight | 126.200 |
| Flash Point | 71.9±9.4 °C |
| Exact Mass | 126.115700 |
| PSA | 15.27000 |
| LogP | 0.56 |
| Vapour Pressure | 0.9±0.3 mmHg at 25°C |
| Index of Refraction | 1.534 |
| InChIKey | XJKNACDCUAFDHD-UHFFFAOYSA-N |
| SMILES | C1CN2CCC(CC2)N1 |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| HS Code | 2933990090 |
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This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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~97%
1,4-Diazabicycl... CAS#:283-38-5 |
| Literature: Curtis, Michael P.; Bunnelle, William H.; Pagano, Thomas G.; Gopalakrishnan, Murali; Faghih, Ramin Synthetic Communications, 2006 , vol. 36, # 3 p. 321 - 326 |
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~%
1,4-Diazabicycl... CAS#:283-38-5 |
| Literature: NeuroSearch A/S; PETERS, Dan; TIMMERMANN, Daniel, B.; NIELSEN, Elsebet, OEstergaard Patent: WO2012/139925 A1, 2012 ; |
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~%
1,4-Diazabicycl... CAS#:283-38-5 |
| Literature: NEUROSEARCH A/S; PETERS, Dan; TIMMERMANN, Daniel, B.; NIELSEN, Elsebet, OEstergaard; DYHRING, Tino; AHRING, Philip, K. Patent: WO2011/73296 A1, 2011 ; WO 2011/073296 A1 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 3 | |
|---|---|
| DownStream 5 | |
This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2933990090 |
|---|---|
| Summary | 2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
This table contains target information, in‑vitro & in‑vivo assay data for this compound.
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Name: Partial agonist activity at human alpha7 nAChR expressed in Xenopus laevis oocytes as...
Source: ChEMBL
Target: Neuronal acetylcholine receptor subunit alpha-7
External Id: CHEMBL4773926
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Name: Partial agonist activity at human alpha7 nAChR expressed in Xenopus laevis oocytes as...
Source: ChEMBL
Target: Neuronal acetylcholine receptor subunit alpha-7
External Id: CHEMBL4773928
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|
Name: Partial agonist activity at human alpha7 nAChR expressed in Xenopus laevis oocytes as...
Source: ChEMBL
Target: Neuronal acetylcholine receptor subunit alpha-7
External Id: CHEMBL4773934
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|
Name: Partial agonist activity at human alpha7 nAChR expressed in Xenopus laevis oocytes at...
Source: ChEMBL
Target: Neuronal acetylcholine receptor subunit alpha-7
External Id: CHEMBL4773933
|
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 1,4-Diazabicyclo[3.2.2]nonane |
| 1,4-Diazobicylco[3.2.2]nonane |
| 1,4-diazabicyclo-[3.2.2]nonane |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the molecular weight of 1,4-diazabicyclo[3.2.2]nonane? |
| A: Molecular weight of 1,4-diazabicyclo[3.2.2]nonane is 126.200. |
| Q: What is the polar surface area (PSA) of 1,4-diazabicyclo[3.2.2]nonane? |
| A: Polar surface area (PSA) of 1,4-diazabicyclo[3.2.2]nonane is 15.27000. |
| Q: What is the InChIKey of 1,4-diazabicyclo[3.2.2]nonane? |
| A: InChIKey of 1,4-diazabicyclo[3.2.2]nonane is XJKNACDCUAFDHD-UHFFFAOYSA-N. |
| Q: What is the LogP of 1,4-diazabicyclo[3.2.2]nonane? |
| A: LogP of 1,4-diazabicyclo[3.2.2]nonane is 0.56. |
| Q: What English synonyms does 1,4-diazabicyclo[3.2.2]nonane have? |
| A: English synonyms of 1,4-diazabicyclo[3.2.2]nonane: 1,4-Diazabicyclo[3.2.2]nonane, 1,4-Diazobicylco[3.2.2]nonane, 1,4-diazabicyclo-[3.2.2]nonane. |
| Q: What is the molecular formula of 1,4-diazabicyclo[3.2.2]nonane? |
| A: Molecular formula of 1,4-diazabicyclo[3.2.2]nonane is C7H14N2. |
| Q: What is the boiling point of 1,4-diazabicyclo[3.2.2]nonane? |
| A: Boiling point of 1,4-diazabicyclo[3.2.2]nonane is 180.0±8.0 °C at 760 mmHg. |
| Q: What is the SMILES notation of 1,4-diazabicyclo[3.2.2]nonane? |
| A: SMILES notation of 1,4-diazabicyclo[3.2.2]nonane is C1CN2CCC(CC2)N1. |
| Q: What are the downstream products of 1,4-diazabicyclo[3.2.2]nonane? |
| A: Related downstream products(CAS) of 1,4-diazabicyclo[3.2.2]nonane: 108437-28-1;298198-52-4;695184-05-5;677723-95-4;439608-12-5. |
| Q: What are the upstream materials of 1,4-diazabicyclo[3.2.2]nonane? |
| A: Related upstream materials(CAS) of 1,4-diazabicyclo[3.2.2]nonane: 53619-11-7;35423-17-7;1193-65-3. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Shanghai Nianxing Industrial Co., Ltd |
| Dayang Chem (Hangzhou) Co., Ltd. |