6-Bromo-4-hydroxy-3-nitroquinoline
6-Bromo-4-hydroxy-3-nitroquinoline structure
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Common Name | 6-Bromo-4-hydroxy-3-nitroquinoline | ||
|---|---|---|---|---|
| CAS Number | 853908-50-6 | Molecular Weight | 269.052 | |
| Density | 1.9±0.1 g/cm3 | Boiling Point | 389.3±37.0 °C at 760 mmHg | |
| Molecular Formula | C9H5BrN2O3 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 189.3±26.5 °C | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 6-Bromo-3-nitro-4-quinolinol |
|---|---|
| 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 | 1.9±0.1 g/cm3 |
|---|---|
| Boiling Point | 389.3±37.0 °C at 760 mmHg |
| Molecular Formula | C9H5BrN2O3 |
| Molecular Weight | 269.052 |
| Flash Point | 189.3±26.5 °C |
| Exact Mass | 267.948334 |
| PSA | 78.94000 |
| LogP | 3.58 |
| Vapour Pressure | 0.0±0.9 mmHg at 25°C |
| Index of Refraction | 1.749 |
| InChIKey | AMKJVYOALDEARM-UHFFFAOYSA-N |
| SMILES | O=c1c([N+](=O)[O-])c[nH]c2ccc(Br)cc12 |
This table provides MSDS information including hazard classification, first‑aid, fire‑fighting, spill handling, operation and storage instructions.
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Material Safety Data Sheet
Section1. Identification of the substance 6-Bromo-3-nitro-4-quinolinol Product Name: Synonyms: Section2. Hazards identification Harmful by inhalation, in contact with skin, and if swallowed.
H315:Causes skin irritation H319:Causes serious eye irritation H335:May cause respiratory irritation P261:Avoid breathing dust/fume/gas/mist/vapours/spray Wear protective gloves/protective clothing/eye protection/face protection P280: P305+P351+P338: IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses if present and easy to do – continue rinsing P304+P340:IF INHALED: Remove victim to fresh air and keep at rest in a position comfortable for breathing P405:Store locked up Section3. Composition/information on ingredients. 6-Bromo-3-nitro-4-quinolinol Ingredient name: CAS number:853908-50-6 Section4. First aid measures Immediately wash skin with copious amounts of water for at least 15 minutes while removing Skin contact: contaminated clothing and shoes. If irritation persists, seek medical attention. Eye contact:Immediately wash skin with copious amounts of water for at least 15 minutes. Assure adequate flushing of the eyes by separating the eyelids with fingers. If irritation persists, seek medical attention. Inhalation:Remove to fresh air. In severe cases or if symptoms persist, seek medical attention. Wash out mouth with copious amounts of water for at least 15 minutes. Seek medical attention. Ingestion: Section5. Fire fighting measures In the event of a fire involving this material, alone or in combination with other materials, use dry powder or carbon dioxide extinguishers. Protective clothing and self-contained breathing apparatus should be worn. Section6. Accidental release measures Personal precautions: Wear suitable personal protective equipment which performs satisfactorily and meets local/state/national standards. Respiratory precaution:Wear approved mask/respirator Hand precaution:Wear suitable gloves/gauntlets Skin protection:Wear suitable protective clothing Eye protection:Wear suitable eye protection Methods for cleaning up: Mix with sand or similar inert absorbent material, sweep up and keep in a tightly closed container for disposal. See section 12. Environmental precautions: Do not allow material to enter drains or water courses. Section7. Handling and storage Handling:This product should be handled only by, or under the close supervision of, those properly qualified in the handling and use of potentially hazardous chemicals, who should take into account the fire, health and chemical hazard data given on this sheet. Storage:Store in closed vessels. Section8. Exposure Controls / Personal protection Engineering Controls: Use only in a chemical fume hood. Personal protective equipment: Wear laboratory clothing, chemical-resistant gloves and safety goggles. General hydiene measures: Wash thoroughly after handling. Wash contaminated clothing before reuse. Section9. Physical and chemical properties Not specified Appearance: Boiling point:No data Melting point:No data Flash point:No data Density:No data Molecular formula:C9H5BrN2O3 Molecular weight:269.1 Section10. Stability and reactivity Conditions to avoid: Heat, flames and sparks. Materials to avoid: Oxidizing agents. Possible hazardous combustion products: Carbon monoxide, nitrogen oxides, hydrogen bromide. Section11. Toxicological information No data. Section12. Ecological information No data. Section13. Disposal consideration Arrange disposal as special waste, by licensed disposal company, in consultation with local waste disposal authority, in accordance with national and regional regulations. Section14. Transportation information Non-harzardous for air and ground transportation. Section15. Regulatory information No chemicals in this material are subject to the reporting requirements of SARA Title III, Section 302, or have known CAS numbers that exceed the threshold reporting levels established by SARA Title III, Section 313. SECTION 16 - ADDITIONAL INFORMATION N/A |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| Hazard Codes | Xi |
|---|---|
| HS Code | 2933499090 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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~62%
6-Bromo-4-hydro... CAS#:853908-50-6 |
| Literature: PIRAMAL LIFE SCIENCES LIMITED; KUMAR, Sanjay; VISHWAKARMA, Ram; MUNDADA, Ramswaroop; DEORE, Vijaykumar; KUMAR, Pramod; SHARMA, Somesh Patent: WO2011/1212 A1, 2011 ; Location in patent: Page/Page column 37-38 ; WO 2011/001212 A1 |
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~60%
6-Bromo-4-hydro... CAS#:853908-50-6 |
| Literature: INTELLIKINE, LLC; REN, Pingda; LIU, Yi; LI, Liansheng; CHAN, Katrina; WILSON, Troy, Edward; CAMPBELL, Simon, Fraser Patent: WO2012/116237 A2, 2012 ; Location in patent: Page/Page column 119 ; WO 2012/116237 A2 |
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~51%
6-Bromo-4-hydro... CAS#:853908-50-6 |
| Literature: Zhang, Wenjuan; Li, Zhi; Zhou, Meng; Wu, Feng; Hou, Xueyan; Luo, Hao; Liu, Hao; Han, Xuan; Yan, Guoyi; Ding, Zhenyu; Li, Rui Bioorganic and Medicinal Chemistry Letters, 2014 , vol. 24, # 3 p. 799 - 807 |
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~%
6-Bromo-4-hydro... CAS#:853908-50-6 |
| Literature: WO2005/54237 A1, ; Page/Page column 53 ; WO 2005/054237 A1 |
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~%
6-Bromo-4-hydro... CAS#:853908-50-6 |
| Literature: WO2012/116237 A2, ; WO 2012/116237 A2 |
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~%
6-Bromo-4-hydro... CAS#:853908-50-6 |
| Literature: Bioorganic and Medicinal Chemistry Letters, , vol. 24, # 3 p. 799 - 807 |
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~%
6-Bromo-4-hydro... CAS#:853908-50-6 |
| Literature: WO2012/116237 A2, ; WO 2012/116237 A2 |
![5-Bromo-2-{[(E)-2-nitrovinyl]amino}benzoic acid structure](https://image.chemsrc.com/caspic/201/853908-49-3.png)
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 7 | |
|---|---|
| DownStream 4 | |
CAS#:915019-51-1
CAS#:723281-72-9![2-(4-(8-BROMO-3-METHYL-2-OXO-2,3-DIHYDRO-1H-IMIDAZO[4,5-C]QUINOLIN-1-YL)PHENYL)-2-METHYLPROPANENITRILE structure](https://image.chemsrc.com/caspic/076/915019-50-0.png)
CAS#:915019-50-0
CAS#:915019-52-2This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2933499090 |
|---|---|
| Summary | 2933499090. other compounds containing in the structure a quinoline or isoquinoline ring-system (whether or not hydrogenated), not further fused. 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.
| 6-Brom-3-nitrochinolin-4-ol |
| 6-Bromo-3-nitroquinolin-4-ol |
| 6-Bromo-3-nitro-4-quinolinol |
| 6-bromo-3-nitro-1H-quinolin-4-one |
| 6-Bromo-4-hydroxy-3-nitroquinoline |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the molecular formula of 6-Bromo-3-nitro-4-quinolinol? |
| A: Molecular formula of 6-Bromo-3-nitro-4-quinolinol is C9H5BrN2O3. |
| Q: What is the polar surface area (PSA) of 6-Bromo-3-nitro-4-quinolinol? |
| A: Polar surface area (PSA) of 6-Bromo-3-nitro-4-quinolinol is 78.94000. |
| Q: What are the upstream materials of 6-Bromo-3-nitro-4-quinolinol? |
| A: Related upstream materials(CAS) of 6-Bromo-3-nitro-4-quinolinol: 1201643-75-5;853908-49-3;145369-94-4;108-24-7;5794-88-7;106-40-1;74189-16-5. |
| Q: What is the English name of 6-Bromo-3-nitro-4-quinolinol? |
| A: The English name of 6-Bromo-3-nitro-4-quinolinol is 6-Bromo-3-nitro-4-quinolinol. |
| Q: What is the boiling point of 6-Bromo-3-nitro-4-quinolinol? |
| A: Boiling point of 6-Bromo-3-nitro-4-quinolinol is 389.3±37.0 °C at 760 mmHg. |
| Q: What is the LogP of 6-Bromo-3-nitro-4-quinolinol? |
| A: LogP of 6-Bromo-3-nitro-4-quinolinol is 3.58. |
| Q: What is the InChIKey of 6-Bromo-3-nitro-4-quinolinol? |
| A: InChIKey of 6-Bromo-3-nitro-4-quinolinol is AMKJVYOALDEARM-UHFFFAOYSA-N. |
| Q: What English synonyms does 6-Bromo-3-nitro-4-quinolinol have? |
| A: English synonyms of 6-Bromo-3-nitro-4-quinolinol: 6-Brom-3-nitrochinolin-4-ol, 6-Bromo-3-nitroquinolin-4-ol, 6-Bromo-3-nitro-4-quinolinol, 6-bromo-3-nitro-1H-quinolin-4-one, 6-Bromo-4-hydroxy-3-nitroquinoline. |
| Q: What is the CAS number of 6-Bromo-3-nitro-4-quinolinol? |
| A: CAS number of 6-Bromo-3-nitro-4-quinolinol is 853908-50-6. |
| Q: What is the molecular weight of 6-Bromo-3-nitro-4-quinolinol? |
| A: Molecular weight of 6-Bromo-3-nitro-4-quinolinol is 269.052. |
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. |