N-(2-Chloropyridin-3-yl)-2-nitrobenzamide
N-(2-Chloropyridin-3-yl)-2-nitrobenzamide structure
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Common Name | N-(2-Chloropyridin-3-yl)-2-nitrobenzamide | ||
|---|---|---|---|---|
| CAS Number | 1028-86-0 | Molecular Weight | 277.663 | |
| Density | 1.5±0.1 g/cm3 | Boiling Point | 377.7±37.0 °C at 760 mmHg | |
| Molecular Formula | C12H8ClN3O3 | Melting Point | 157-159°C | |
| MSDS | N/A | Flash Point | 182.2±26.5 °C | |
Summary: N-(2-Chloropyridin-3-yl)-2-nitrobenzamide (CAS number: 1028-86-0), with molecular formula C12H8ClN3O3 and molecular weight 277.663, is used as an intermediate for piperitone synthesis. 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 | N-(2-Chloropyridin-3-yl)-2-nitrobenzamide |
|---|---|
| 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 | 1.5±0.1 g/cm3 |
|---|---|
| Boiling Point | 377.7±37.0 °C at 760 mmHg |
| Melting Point | 157-159°C |
| Molecular Formula | C12H8ClN3O3 |
| Molecular Weight | 277.663 |
| Flash Point | 182.2±26.5 °C |
| Exact Mass | 277.025421 |
| PSA | 87.81000 |
| LogP | 1.84 |
| Vapour Pressure | 0.0±0.9 mmHg at 25°C |
| Index of Refraction | 1.684 |
| InChIKey | JZEBEDCRJXPXIC-UHFFFAOYSA-N |
| SMILES | O=C(Nc1cccnc1Cl)c1ccccc1[N+](=O)[O-] |
| Storage condition | 2-8°C |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| Hazard Codes | Xi |
|---|---|
| HS Code | 2933399090 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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~99%
N-(2-Chloropyri... CAS#:1028-86-0 |
| Literature: SIRTRIS PHARMACEUTICALS, INC. Patent: WO2009/61453 A1, 2009 ; Location in patent: Page/Page column 65 ; WO 2009/061453 A1 |
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N-(2-Chloropyri... CAS#:1028-86-0 |
| Literature: Journal of Medicinal Chemistry, , vol. 47, # 17 p. 4300 - 4315 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 3 | |
|---|---|
| DownStream 5 | |
![5,6-Dihydro-6-oxo-11H-pyrido[2,3-b][1,4]benzodiazepine structure](https://image.chemsrc.com/caspic/061/885-70-1.png)
CAS#:885-70-1![5,11-Dihydro-11-chloroacetyl-6h-pyrido[2,3-b][1,4]benzodiazepine-6-one structure](https://image.chemsrc.com/caspic/041/28797-48-0.png)
CAS#:28797-48-0
CAS#:826991-83-7
CAS#:826991-84-8
CAS#:956-30-9This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2933399090 |
|---|---|
| Summary | 2933399090. other compounds containing an unfused pyridine ring (whether or not hydrogenated) in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| N-(2-Chloro-3-pyridinyl)-2-nitrobenzamide |
| N-(2-Chloro-pyridin-3-yl)-2-nitro-benzamide |
| n-(2-chloropyridin-3-yl)-2-nitrobenzamide |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the CAS number of N-(2-Chloropyridin-3-yl)-2-nitrobenzamide? |
| A: CAS number of N-(2-Chloropyridin-3-yl)-2-nitrobenzamide is 1028-86-0. |
| Q: What are the storage conditions for N-(2-Chloropyridin-3-yl)-2-nitrobenzamide? |
| A: Storage conditions for N-(2-Chloropyridin-3-yl)-2-nitrobenzamide: 2-8°C. |
| Q: What is the SMILES notation of N-(2-Chloropyridin-3-yl)-2-nitrobenzamide? |
| A: SMILES notation of N-(2-Chloropyridin-3-yl)-2-nitrobenzamide is O=C(Nc1cccnc1Cl)c1ccccc1[N+](=O)[O-]. |
| Q: What are the downstream products of N-(2-Chloropyridin-3-yl)-2-nitrobenzamide? |
| A: Related downstream products(CAS) of N-(2-Chloropyridin-3-yl)-2-nitrobenzamide: 885-70-1;28797-48-0;826991-83-7;826991-84-8;956-30-9. |
| Q: What are the upstream materials of N-(2-Chloropyridin-3-yl)-2-nitrobenzamide? |
| A: Related upstream materials(CAS) of N-(2-Chloropyridin-3-yl)-2-nitrobenzamide: 6298-19-7;610-14-0;552-16-9. |
| Q: What is the English name of N-(2-Chloropyridin-3-yl)-2-nitrobenzamide? |
| A: The English name of N-(2-Chloropyridin-3-yl)-2-nitrobenzamide is N-(2-Chloropyridin-3-yl)-2-nitrobenzamide. |
| Q: What English synonyms does N-(2-Chloropyridin-3-yl)-2-nitrobenzamide have? |
| A: English synonyms of N-(2-Chloropyridin-3-yl)-2-nitrobenzamide: N-(2-Chloro-3-pyridinyl)-2-nitrobenzamide, N-(2-Chloro-pyridin-3-yl)-2-nitro-benzamide, n-(2-chloropyridin-3-yl)-2-nitrobenzamide. |
| Q: What is the LogP of N-(2-Chloropyridin-3-yl)-2-nitrobenzamide? |
| A: LogP of N-(2-Chloropyridin-3-yl)-2-nitrobenzamide is 1.84. |
| Q: What is the molecular formula of N-(2-Chloropyridin-3-yl)-2-nitrobenzamide? |
| A: Molecular formula of N-(2-Chloropyridin-3-yl)-2-nitrobenzamide is C12H8ClN3O3. |
| Q: What is the InChIKey of N-(2-Chloropyridin-3-yl)-2-nitrobenzamide? |
| A: InChIKey of N-(2-Chloropyridin-3-yl)-2-nitrobenzamide is JZEBEDCRJXPXIC-UHFFFAOYSA-N. |
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. |