3-溴-6-乙氧基-2-甲基吡啶 | 610278-93-8

• 分子结构分类: 有机化合物 - 有机氧化合物
• 中文名称: 3-溴-6-乙氧基-2-甲基吡啶
• 中文别名: 3-溴-6-乙氧基甲基吡啶
• 英文名称: 3-bromo-6-ethoxy-2-methylpyridine
• CAS: 610278-93-8
• 化学式: C₈H₁₀BrNO
• 分子量: 216.077
• InChiKey: GEBGDYWVDOXQAE-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.6
• 重原子数：
  11
• 可旋转键数：
  2
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.38
• 拓扑面积：
  22.1
• 氢给体数：
  0
• 氢受体数：
  2

安全信息

• 海关编码：
  2933399090

SDS

Material Safety Data Sheet

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Section 1. Identification of the substance
Product Name: 3-Bromo-6-ethoxypicoline
Synonyms: 3-Bromo-6-ethoxy-2-methylpyridine

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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: 3-Bromo-6-ethoxypicoline
CAS number: 610278-93-8

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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: C8H10BrNO
Molecular weight: 216.1

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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：

  3-溴-6-乙氧基-2-甲基吡啶 在 二(三叔丁基膦)钯 、 水 、 potassium carbonate 、 lithium hydroxide 作用下， 以 四氢呋喃 、 1,4-二氧六环 、 甲醇 、 水 为溶剂， 反应 8.0h， 生成 5-(6-Ethoxy-2-methylpyridin-3-yl)-1-methylpyrazole-3-carboxylic acid
  参考文献：
  名称：

  PYRIDINYL-SUBSTITUTED PYRAZOLYL CARBOXAMIDES

  摘要：

  这项发明涉及以吡唑基为基础的羧酰胺化合物，其作为ICRAC抑制剂有用，涉及含有这些化合物的药物组合物以及使用这些化合物治疗和/或预防疾病和/或疾病的方法，特别是炎症性疾病和/或炎症性疾病。

  公开号：

  US20150166505A1
• 作为产物：
  描述：

  sodium ethanolate 、 5-溴-2-氟-6-甲基吡啶 在 乙酸乙酯 作用下， 以 乙醇 、 水 为溶剂， 反应 1.0h， 以to yield the desired compound (560 mg, 98%)的产率得到3-溴-6-乙氧基-2-甲基吡啶
  参考文献：
  名称：

  PYRIDINYL-SUBSTITUTED PYRAZOLYL CARBOXAMIDES

  摘要：

  本发明涉及以吡唑基为基础的羧酰胺化合物，其作为ICRAC抑制剂有用，以及含有这些化合物的制药组合物和使用这些化合物治疗和/或预防疾病和/或疾病的方法，特别是炎症性疾病和/或炎症性疾病。

  公开号：

  US20150166505A1

文献信息

• [EN] PYRAZOLYL-BASED CARBOXAMIDES IV<br/>[FR] CARBOXAMIDES À BASE DE PYRAZOLYLE SERVANT D'INHIBITEURS DE CANAL CRAC
  申请人：GRUENENTHAL GMBH

  公开号：WO2015090579A1

  公开（公告）日：2015-06-25

  The invention relates to pyrazolyl-based carboxamide compounds (formula I) useful as ICRAC inhibitors, to pharmaceutical compositions containing these compounds and to these compounds for the use in the treatment and/or prophylaxis of diseases and/or disorders, in particular inflammatory diseases and/or inflammatory disorders.
• PYRIDINYL-SUBSTITUTED PYRAZOLYL CARBOXAMIDES
  申请人：GRÜNENTHAL GMBH

  公开号：US20150166505A1

  公开（公告）日：2015-06-18

  The invention relates to pyrazolyl-based carboxamide compounds useful as ICRAC inhibitors, to pharmaceutical compositions containing these compounds and to methods of using these compounds for the treatment and/or prophylaxis of diseases and/or disorders, in particular inflammatory diseases and/or inflammatory disorders.

  这项发明涉及以吡唑基为基础的羧酰胺化合物，其作为ICRAC抑制剂有用，涉及含有这些化合物的药物组合物以及使用这些化合物治疗和/或预防疾病和/或疾病的方法，特别是炎症性疾病和/或炎症性疾病。