5-氨基-8-溴喹啉 | 116632-58-7

• 物质功能分类: 医药中间体 - 喹啉类化合物
• 分子结构分类: 有机化合物 - 有机杂环化合物 - 喹啉及其衍生物
• 中文名称: 5-氨基-8-溴喹啉
• 英文名称: 5-amino-8-bromoquinoline
• 英文别名: 8-bromo-5-aminoquinoline；8-bromo-[5]quinolylamine；8-Brom-[5]chinolylamin；8-Bromoquinolin-5-amine
• CAS: 116632-58-7
• 化学式: C₉H₇BrN₂
• 分子量: 223.072
• InChiKey: UNFYSPONYGTMNH-UHFFFAOYSA-N

物化性质

• 沸点：
  353.3±27.0 °C(Predicted)
• 密度：
  1.649±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  2.6
• 重原子数：
  12
• 可旋转键数：
  0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  38.9
• 氢给体数：
  1
• 氢受体数：
  2

安全信息

• 海关编码：
  2933499090
• 危险性防范说明：
  P305+P351+P338
• 危险性描述：
  H315,H319
• 储存条件：
  应存于室温、避光且在惰性气体保护下。

SDS

Material Safety Data Sheet

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Section 1. Identification of the substance
Product Name: 5-Amino-8-bromoquinoline
Synonyms: 8-Bromoquinolin-5-amine

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Section 2. Hazards identification
Harmful by inhalation, in contact with skin, and if swallowed.

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Section 3. Composition/information on ingredients.
Ingredient name: 5-Amino-8-bromoquinoline
CAS number: 116632-58-7

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Section 4. First aid measures
Skin contact: Immediately wash skin with copious amounts of water for at least 15 minutes while removing
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.
Ingestion: Wash out mouth with copious amounts of water for at least 15 minutes. Seek medical attention.

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Section 5. 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.

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Section 6. 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.

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Section 7. 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.
Store in closed vessels.
Storage:

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Section 8. 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.

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Section 9. Physical and chemical properties
Appearance: Not specified
Boiling point: No data
No data
Melting point:
Flash point: No data
Density: No data
Molecular formula: C9H7BrN2
Molecular weight: 223.1

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Section 10. 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.

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Section 11. Toxicological information
No data.

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Section 12. Ecological information
No data.

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Section 13. 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.

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Section 14. Transportation information
Non-harzardous for air and ground transportation.

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Section 15. 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.

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SECTION 16 - ADDITIONAL INFORMATION
N/A

反应信息

• 作为反应物：
  描述：

  5-氨基-8-溴喹啉 在 盐酸 、 乙醇 作用下， 生成 8-sulfanilyl-[5]quinolylamine
  参考文献：
  名称：

  Some Chemotherapeutically Active Sulfones.¹ I

  摘要：

  DOI：

  10.1021/ja01220a049
• 作为产物：
  描述：

  alkaline earth salt of/the/ methylsulfuric acid 在 盐酸 作用下， 生成 5-氨基-8-溴喹啉
  参考文献：
  名称：

  Claus; Setzer, Journal fur praktische Chemie (Leipzig 1954), 1896, vol. <2> 53, p. 392

  摘要：

  DOI：

文献信息

• AZA-ARYL 1H-PYRAZOL-1-YL BENZENE SULFONAMIDES
  申请人：ChemoCentryx, Inc.

  公开号：US20180009797A1

  公开（公告）日：2018-01-11

  Compounds are provided that act as potent antagonists of the CCR(9) receptor for treating Sjogren's syndrome. The compounds are generally aryl sulfonamide derivatives and are useful in pharmaceutical compositions.

  提供了作为治疗Sjogren综合征的CCR(9)受体的有效拮抗剂的化合物。这些化合物通常是芳基磺酰胺衍生物，并且在制药组合物中很有用。
• Hetaroyl cyclohexanedione derivatives with herbicidal effect
  申请人：BASF Aktiengesellschaft

  公开号：US06479436B1

  公开（公告）日：2002-11-12

  Hetaroyl derivatives of the formula I where: R1 and R2 are each hydrogen, nitro, halogen, cyano, thiocyanato, hydroxyl, mercapto, C1-C6-alkyl, C1-C6-alkoxy, C1-C6-alkylthio, C1-C6-alkylsulfinyl, C1-C6-alkylsulfonyl or C1-C6-alkoxysulfonyl, where the last 6 radicals may be substituted and/or functionalized; phenyl, phenoxy, phenylthio, phenylsulfinyl or phenylsulfonyl, where the last 5 radicals may be substituted; Z is an unsubstituted or substituted four-membered unsaturated, partially or fully saturated chain consisting of three carbons and one nitrogen; Q is unsubstituted or substituted cyclohexane-1,3-dione linked at position 2; and their agriculturally useful salts. A process for preparing the hetaroyl derivatives, compositions comprising them, and the use of these derivatives or these compositions comprising them for controlling undesirable plants.

  公式I的Hetaroyl衍生物，其中：R1和R2分别是氢、硝基、卤素、氰基、硫氰酸基、羟基、巯基、C1-C6-烷基、C1-C6-烷氧基、C1-C6-烷硫基、C1-C6-烷基亚硫酰基、C1-C6-烷基磺酰基或C1-C6-烷氧基磺酰基，其中最后6个基团可以被取代和/或官能化；苯基、苯氧基、苯基硫基、苯基亚硫酰基或苯基磺酰基，其中最后5个基团可以被取代；Z是未取代或取代的四元不饱和、部分或完全饱和链，由三个碳和一个氮组成；Q是未取代或取代的环己烷-1,3-二酮，连接在位置2；以及它们的在农业上有用的盐。制备Hetaroyl衍生物的方法，包含它们的组合物，以及使用这些衍生物或包含它们的组合物来控制不良植物。
• 4-Hetaroylpyrazol derivatives and the use thereof as herbicides
  申请人：BASF Aktiengesellschaft

  公开号：US06262074B1

  公开（公告）日：2001-07-17

  Hetaroyl derivatives of the formula I where: R1 and R2 are each hydrogen, nitro, halogen, cyano, thiocyanato, hydroxyl, mercapto, C1-C6-alkyl, C1-C6-alkoxy, C1-C6-alkylthio, C1-C6-alkylsulfinyl, C1-C6-alkylsulfonyl or C1-C6-alkoxysulfonyl, where the last 6 radicals may be substituted and/or functionalized; phenyl, phenoxy, phenylthio, phenylsulfinyl or phenylsulfonyl, where the last 5 radicals may be substituted; Z is an unsubstituted or substituted four-membered unsaturated, partially or fully saturated chain consisting of three carbons and one nitrogen; Q is unsubstituted or substituted hydroxypyrazole linked at position 4; and their agriculturally useful salts. A process for preparing the hetaroyl derivatives, compositions comprising them, and the use of these derivatives or these compositions comprising them for controlling undesirable plants.

  公式I的Hetaroyl衍生物，其中：R1和R2分别为氢、硝基、卤素、氰基、硫氰酸基、羟基、巯基、C1-C6-烷基、C1-C6-烷氧基、C1-C6-烷基硫基、C1-C6-烷基亚硫酰基、C1-C6-烷基磺酰基或C1-C6-烷氧基磺酰基，最后6个基团可能被取代和/或官能化；苯基、苯氧基、苯硫基、苯亚硫酰基或苯磺酰基，最后5个基团可能被取代；Z是未取代或取代的四元不饱和、部分饱和或完全饱和链，由三个碳和一个氮组成；Q是未取代或取代的连接在位置4的羟基吡唑；及其农业上有用的盐。一种制备Hetaroyl衍生物的方法，包含它们的组合物，以及使用这些衍生物或包含它们的组合物来控制不良植物。
• 一种喹啉取代吡啶化合物及其应用
  申请人：烟台显华科技集团股份有限公司

  公开号：CN115521292B

  公开（公告）日：2023-04-07

  本发明属于有机发光显示技术领域，公开了一种喹啉取代吡啶化合物及其应用。所述化合物具有如式（I）所示的结构，其具有喹啉取代吡啶片段的母体结构，具备较大的共轭平面，原子间的键能高，有利于分子间的固态堆积，表现出良好的热力学稳定性。同时，本发明提供的结构，能够有效与金属发生络合作用，在作为电荷产生层材料应用时，能够提高电荷产生的效率。本发明的有机电致发光器件包含本发明的化合物作为电子传输材料，可以有效降低驱动电压，提高发光效率，延长有机电致发光器件的使用寿命。本发明提供的显示装置具有优良的显示效果。（I）。
• Aza-aryl 1H-pyrazol-1-yl benzene sulfonamides
  申请人：ChemoCentryx, Inc.

  公开号：US10137120B2

  公开（公告）日：2018-11-27

  Compounds are provided that act as potent antagonists of the CCR(9) receptor. Animal testing demonstrates that these compounds are useful for treating inflammation, a hallmark disease for CCR(9). The compounds are generally aryl sulfonamide derivatives and are useful in pharmaceutical compositions, methods for the treatment of CCR(9)-mediated diseases, and as controls in assays for the identification of CCR(9) antagonists.

  本研究提供了可作为 CCR(9) 受体强效拮抗剂的化合物。动物试验证明，这些化合物可用于治疗炎症--CCR(9)的标志性疾病。这些化合物通常是芳基磺酰胺衍生物，可用于药物组合物、治疗 CCR(9) 介导的疾病的方法，以及用作鉴定 CCR(9) 拮抗剂的测定中的对照物。