1-Bromo-2-chloro-3-nitrobenzene
1-Bromo-2-chloro-3-nitrobenzene structure
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Common Name | 1-Bromo-2-chloro-3-nitrobenzene | ||
|---|---|---|---|---|
| CAS Number | 3970-37-4 | Molecular Weight | 236.451 | |
| Density | 1.8±0.1 g/cm3 | Boiling Point | 290.4±20.0 °C at 760 mmHg | |
| Molecular Formula | C6H3BrClNO2 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 129.4±21.8 °C | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 1-Bromo-2-chloro-3-nitrobenzene |
|---|---|
| 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 | 1.8±0.1 g/cm3 |
|---|---|
| Boiling Point | 290.4±20.0 °C at 760 mmHg |
| Molecular Formula | C6H3BrClNO2 |
| Molecular Weight | 236.451 |
| Flash Point | 129.4±21.8 °C |
| Exact Mass | 234.903564 |
| PSA | 45.82000 |
| LogP | 2.82 |
| Vapour Pressure | 0.0±0.6 mmHg at 25°C |
| Index of Refraction | 1.619 |
| InChIKey | JNIDAGAFFKAPRV-UHFFFAOYSA-N |
| SMILES | O=[N+]([O-])c1cccc(Br)c1Cl |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| Hazard Codes | Xi |
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This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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1-Bromo-2-chlor... CAS#:3970-37-4 |
| Literature: Vara Prasad; Boyer, Frederick E.; Chupak, Lou; Dermyer, Michael; Ding, Qizhu; Gavardinas; Hagen, Susan E.; Huband, Michael D.; Jiao, Wenhua; Kaneko, Takushi; Maiti, Samarendra N.; Melnick, Michael; Romero, Karina; Patterson; Wu, Xiujuan Bioorganic and Medicinal Chemistry Letters, 2006 , vol. 16, # 20 p. 5392 - 5397 |
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1-Bromo-2-chlor... CAS#:3970-37-4 |
| Literature: GLAXO GROUP LIMITED; CHAMBERS, Laura Jane; DEAN, David Kenneth; MUNOZ-MURIEDAS, Jorge; STEADMAN, Jon Graham Anthony; WALTER, Daryl Simon Patent: WO2010/125103 A1, 2010 ; Location in patent: Page/Page column 78 ; WO 2010/125103 A1 |
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1-Bromo-2-chlor... CAS#:3970-37-4 |
| Literature: Takeda Pharmaceutical Company Limited Patent: EP1847541 A1, 2007 ; Location in patent: Page/Page column 71-72 ; EP 1847541 A1 |
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1-Bromo-2-chlor... CAS#:3970-37-4 |
| Literature: Koerner; Contardi Atti della Accademia Nazionale dei Lincei, Classe di Scienze Fisiche, Matematiche e Naturali, Rendiconti, 1906 , vol. <5> 15 I, p. 526 |
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1-Bromo-2-chlor... CAS#:3970-37-4 |
| Literature: Koerner; Contardi Atti della Accademia Nazionale dei Lincei, Classe di Scienze Fisiche, Matematiche e Naturali, Rendiconti, 1906 , vol. <5> 15 I, p. 526 |
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1-Bromo-2-chlor... CAS#:3970-37-4 |
| Literature: Liedholm, Brita Acta Chemica Scandinavica, Series B: Organic Chemistry and Biochemistry, 1988 , vol. 42, # 4 p. 237 - 241 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 6 | |
|---|---|
| DownStream 2 | |
CAS#:58534-94-4
CAS#:98775-19-0This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 1-Bromo-2-chloro-3-nitrobenzene |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the InChIKey of 1-Bromo-2-chloro-3-nitrobenzene? |
| A: InChIKey of 1-Bromo-2-chloro-3-nitrobenzene is JNIDAGAFFKAPRV-UHFFFAOYSA-N. |
| Q: What is the SMILES notation of 1-Bromo-2-chloro-3-nitrobenzene? |
| A: SMILES notation of 1-Bromo-2-chloro-3-nitrobenzene is O=[N+]([O-])c1cccc(Br)c1Cl. |
| Q: What is the molecular weight of 1-Bromo-2-chloro-3-nitrobenzene? |
| A: Molecular weight of 1-Bromo-2-chloro-3-nitrobenzene is 236.451. |
| Q: What is the polar surface area (PSA) of 1-Bromo-2-chloro-3-nitrobenzene? |
| A: Polar surface area (PSA) of 1-Bromo-2-chloro-3-nitrobenzene is 45.82000. |
| Q: What are the downstream products of 1-Bromo-2-chloro-3-nitrobenzene? |
| A: Related downstream products(CAS) of 1-Bromo-2-chloro-3-nitrobenzene: 58534-94-4;98775-19-0. |
| Q: What is the English name of 1-Bromo-2-chloro-3-nitrobenzene? |
| A: The English name of 1-Bromo-2-chloro-3-nitrobenzene is 1-Bromo-2-chloro-3-nitrobenzene. |
| Q: What is the boiling point of 1-Bromo-2-chloro-3-nitrobenzene? |
| A: Boiling point of 1-Bromo-2-chloro-3-nitrobenzene is 290.4±20.0 °C at 760 mmHg. |
| Q: What English synonyms does 1-Bromo-2-chloro-3-nitrobenzene have? |
| A: English synonyms of 1-Bromo-2-chloro-3-nitrobenzene: 1-Bromo-2-chloro-3-nitrobenzene. |
| Q: What is the molecular formula of 1-Bromo-2-chloro-3-nitrobenzene? |
| A: Molecular formula of 1-Bromo-2-chloro-3-nitrobenzene is C6H3BrClNO2. |
| Q: What is the LogP of 1-Bromo-2-chloro-3-nitrobenzene? |
| A: LogP of 1-Bromo-2-chloro-3-nitrobenzene is 2.82. |
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. |
| Henan Tianfu Chemical Co., Ltd. |