6-甲基-4-(三氟甲基)吡啶-2-基-肼 | 22123-09-7

• 物质功能分类: 生物 - 细胞培养 - 培养基
• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡啶及其衍生物
• 中文名称: 6-甲基-4-(三氟甲基)吡啶-2-基-肼
• 中文别名: 1-[6-甲基-4-（三氟甲基）-2-吡啶肼；1-[6-甲基-4-(三氟甲基)-2-吡啶]肼；1-[6-甲基-4-(三氟甲基)-2-吡啶肼
• 英文名称: 6-methyl-4-(trifluoromethyl) pyrid-2-yl-hydrazine
• 英文别名: 4-(trifluoromethyl)-6-methyl-2-pyridylhydrazine；2-hydrazinyl-6-methyl-4-(trifluoromethyl)pyridine；6-Methyl-4-trifluormethyl-2-hydrazino-pyridin；2-hydrazino-6-methyl-4-trifluoromethyl-pyridine；[6-methyl-4-(trifluoromethyl)pyridin-2-yl]hydrazine
• CAS: 22123-09-7
• 化学式: C₇H₈F₃N₃
• mdl: MFCD00052901
• 分子量: 191.156
• InChiKey: MBJJCIYNRRPIGV-UHFFFAOYSA-N

物化性质

• 熔点：
  79 °C
• 沸点：
  199.6±50.0 °C(Predicted)
• 密度：
  1.40±0.1 g/cm3(Predicted)
• 稳定性/保质期：
  <p><b></b></p>

计算性质

• 辛醇/水分配系数(LogP)：
  1.7
• 重原子数：
  13
• 可旋转键数：
  1
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.285
• 拓扑面积：
  50.9
• 氢给体数：
  2
• 氢受体数：
  6

安全信息

• 危险品标志：
  Xn
• 安全说明：
  S36/37
• 危险类别码：
  R20/21/22
• 海关编码：
  2933990090

SDS

Name:	1-[6-Methyl-4-(trifluoromethyl)-2-pyridyl]hydrazine 97% Material Safety Data Sheet
Synonym:
CAS:	22123-09-7

Section 1 - Chemical Product MSDS Name:1-[6-Methyl-4-(trifluoromethyl)-2-pyridyl]hydrazine 97% Material Safety Data Sheet
Synonym:

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Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS

CAS#	Chemical Name	content	EINECS#
22123-09-7	1-[6-Methyl-4-(trifluoromethyl)-2-pyri	97%	unlisted

Hazard Symbols: XN
Risk Phrases: 20/21/22

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Section 3 - HAZARDS IDENTIFICATION
EMERGENCY OVERVIEW
Harmful by inhalation, in contact with skin and if swallowed.
Potential Health Effects
Eye:
May cause eye irritation.
Skin:
May cause skin irritation. Harmful if absorbed through the skin.
Ingestion:
Harmful if swallowed. May cause irritation of the digestive tract.
Inhalation:
Harmful if inhaled. May cause respiratory tract irritation.
Chronic:
Not available.

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Section 4 - FIRST AID MEASURES
Eyes: Flush eyes with plenty of water for at least 15 minutes, occasionally lifting the upper and lower eyelids. Get medical aid.
Skin:
Get medical aid. Flush skin with plenty of water for at least 15 minutes while removing contaminated clothing and shoes.
Ingestion:
Get medical aid. Wash mouth out with water.
Inhalation:
Remove from exposure and move to fresh air immediately. If not breathing, give artificial respiration. If breathing is difficult, give oxygen. Get medical aid.
Notes to Physician:

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Section 5 - FIRE FIGHTING MEASURES
General Information:
As in any fire, wear a self-contained breathing apparatus in pressure-demand, MSHA/NIOSH (approved or equivalent), and full protective gear.
Extinguishing Media:
Use water spray, dry chemical, carbon dioxide, or chemical foam.

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Section 6 - ACCIDENTAL RELEASE MEASURES
General Information: Use proper personal protective equipment as indicated in Section 8.
Spills/Leaks:
Vacuum or sweep up material and place into a suitable disposal container.

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Section 7 - HANDLING and STORAGE
Handling:
Avoid breathing dust, vapor, mist, or gas. Avoid contact with skin and eyes.
Storage:
Store in a cool, dry place. Store in a tightly closed container.

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Section 8 - EXPOSURE CONTROLS, PERSONAL PROTECTION
Engineering Controls:
Use adequate ventilation to keep airborne concentrations low.
Exposure Limits CAS# 22123-09-7: Personal Protective Equipment Eyes: Not available.
Skin:
Wear appropriate protective gloves to prevent skin exposure.
Clothing:
Wear appropriate protective clothing to prevent skin exposure.
Respirators:
Follow the OSHA respirator regulations found in 29 CFR 1910.134 or European Standard EN 149. Use a NIOSH/MSHA or European Standard EN 149 approved respirator if exposure limits are exceeded or if irritation or other symptoms are experienced.

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Section 9 - PHYSICAL AND CHEMICAL PROPERTIES

Physical State: Solid
Color: pale yellow
Odor: odorless
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: Not available.
Freezing/Melting Point: 82 - 83 deg C
Autoignition Temperature: Not available.
Flash Point: Not available.
Explosion Limits, lower: Not available.
Explosion Limits, upper: Not available.
Decomposition Temperature: Not available.
Solubility in water:
Specific Gravity/Density:
Molecular Formula: C7H8F3N3
Molecular Weight: 191

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Section 10 - STABILITY AND REACTIVITY
Chemical Stability:
Not available.
Conditions to Avoid:
Incompatible materials.
Incompatibilities with Other Materials:
Strong oxidizing agents.
Hazardous Decomposition Products:
Nitrogen oxides, carbon monoxide, carbon dioxide, fluorine, hydrogen fluoride gas.
Hazardous Polymerization: Has not been reported

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Section 11 - TOXICOLOGICAL INFORMATION
RTECS#:
CAS# 22123-09-7 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
1-[6-Methyl-4-(trifluoromethyl)-2-pyridyl]hydrazine - Not listed by ACGIH, IARC, or NTP.

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Section 12 - ECOLOGICAL INFORMATION

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Section 13 - DISPOSAL CONSIDERATIONS
Dispose of in a manner consistent with federal, state, and local regulations.

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Section 14 - TRANSPORT INFORMATION

IATA
Shipping Name: TOXIC SOLID, ORGANIC, N.O.S.*
Hazard Class: 6.1
UN Number: 2811
Packing Group: III
IMO
Shipping Name: TOXIC SOLID, ORGANIC, N.O.S.
Hazard Class: 6.1
UN Number: 2811
Packing Group: III
RID/ADR
Shipping Name: TOXIC SOLID, ORGANIC, N.O.S.
Hazard Class: 6.1
UN Number: 2811
Packing group: III

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Section 15 - REGULATORY INFORMATION

European/International Regulations
European Labeling in Accordance with EC Directives
Hazard Symbols: XN
Risk Phrases:
R 20/21/22 Harmful by inhalation, in contact with
skin and if swallowed.
Safety Phrases:
S 36/37 Wear suitable protective clothing and
gloves.
WGK (Water Danger/Protection)
CAS# 22123-09-7: No information available.
Canada
None of the chemicals in this product are listed on the DSL/NDSL list.
CAS# 22123-09-7 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 22123-09-7 is not listed on the TSCA inventory.
It is for research and development use only.

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SECTION 16 - ADDITIONAL INFORMATION
N/A

制备方法与用途

合成制备方法

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用途

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反应信息

• 作为反应物：
  描述：

  6-甲基-4-(三氟甲基)吡啶-2-基-肼 在 sodium hydride 作用下， 以 四氢呋喃 、 氯仿 为溶剂， 反应 6.5h， 生成 S00084
  参考文献：
  名称：

  Compounds with anti-cancer activity

  摘要：

  提供了一种新型的取代咪唑二酮，可以杀死细胞，抑制细胞增殖，抑制细胞生长，废除细胞周期G2检查点和/或导致对G2细胞周期阻滞的适应。提供了制备和使用该发明化合物的方法。该发明提供了取代咪唑二酮来治疗细胞增殖紊乱。该发明包括使用取代咪唑二酮来选择性地杀死或抑制癌细胞，而无需额外的抗癌治疗。该发明包括使用细胞周期G2检查点废除的取代咪唑二酮来选择性地使癌细胞对DNA损伤试剂、治疗和/或其他类型的抗癌试剂产生敏感性。

  公开号：

  US20080275057A1
• 作为产物：
  描述：

  2-氯-6-甲基-4-(三氟甲基)吡啶 在 一水合肼 作用下， 以 乙醇 为溶剂， 生成 6-甲基-4-(三氟甲基)吡啶-2-基-肼
  参考文献：
  名称：

  [EN] SUBSTITUTED AZOLE DIONE COMPOUNDS WITH ANTIVIRAL ACTIVITY
  [FR] COMPOSÉS AZOLE DIONE SUBSTITUÉS À ACTIVITÉ ANTIVIRALE

  摘要：

  本文提供了使用替代咪唑二酮化合物治疗病毒感染的方法。

  公开号：

  WO2021194954A1

文献信息

• Compounds with anti-cancer activity
  申请人：Kawabe Takumi

  公开号：US20080275057A1

  公开（公告）日：2008-11-06

  Novel substituted azole diones are provided that kill cells, suppress cell proliferation, suppress cell growth, abrogate the cell cycle G2 checkpoint and/or cause adaptation to G2 cell cycle arrest. Methods of making and using the invention compounds are provided. The invention provides substituted azole diones to treat cell proliferation disorders. The invention includes the use of substituted azole diones to selectively kill or suppress cancer cells without additional anti-cancer treatment. The invention includes the use of cell cycle G2-checkpoint-abrogating substituted azole diones to selectively sensitize cancer cells to DNA damaging reagents, treatments and/or other types of anti-cancer reagents.

  提供了一种新型的取代咪唑二酮，可以杀死细胞，抑制细胞增殖，抑制细胞生长，废除细胞周期G2检查点和/或导致对G2细胞周期阻滞的适应。提供了制备和使用该发明化合物的方法。该发明提供了取代咪唑二酮来治疗细胞增殖紊乱。该发明包括使用取代咪唑二酮来选择性地杀死或抑制癌细胞，而无需额外的抗癌治疗。该发明包括使用细胞周期G2检查点废除的取代咪唑二酮来选择性地使癌细胞对DNA损伤试剂、治疗和/或其他类型的抗癌试剂产生敏感性。
• DISUBSTITUTED HETEROARYL-FUSED PYRIDINES
  申请人：Babiger Sangamesh

  公开号：US20120258973A1

  公开（公告）日：2012-10-11

  The invention relates to compound of the formula (I′) in which the substituents are as defined in the specification; in free form or in salt form; to its preparation, to its use as medicament and to medicaments comprising it.

  这项发明涉及式(I′)的化合物，其中取代基如规范中所定义；以自由形式或盐形式存在；其制备，其作为药物的用途以及包含它的药物。
• [EN] PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO<br/>[FR] COMPOSITIONS PESTICIDES ET PROCÉDÉS QUI LEUR SONT ASSOCIÉS
  申请人：DOW AGROSCIENCES LLC

  公开号：WO2013106254A1

  公开（公告）日：2013-07-18

  This document discloses pesticidal compositions comprising molecules having the following formula ("Formula One"): and processes related thereto.

  该文件披露了包含具有以下分子式（“公式一”）的杀虫剂组合物，以及相关的工艺。
• [EN] PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO<br/>[FR] COMPOSITIONS PESTICIDES ET PROCESSUS ASSOCIÉS À CELLES-CI
  申请人：DOW AGROSCIENCES LLC

  公开号：WO2014126580A1

  公开（公告）日：2014-08-21

  This document discloses pesticidal compositions comprising molecules having the following formula ("Formula One"), - Structure- wherein the compositions further comprise one or more of additional pesticidally active components. Also disclosed are processes for applying the pesticidal composition to plants, seeds and to soil where the plants are going to be planted. The inventive pesticidal compositions are effective toward eradicating pests such as BAW, CEW and GPA.

  本文件披露了包含具有以下公式（"公式一"）的分子的杀虫组合物，其中这些组合物进一步包括一种或多种额外的杀虫活性成分。还披露了将杀虫组合物应用于植物、种子和即将种植的土壤的过程。这种创新的杀虫组合物对于根除诸如BAW、CEW和GPA等害虫是有效的。
• A simple and efficient automatable one step synthesis of triazolopyridines from carboxylic acids
  作者：Ying Wang、Kathy Sarris、Daryl R. Sauer、Stevan W. Djuric

  DOI：10.1016/j.tetlet.2007.02.004

  日期：2007.3

  Triazolopyridines can be rapidly and efficiently synthesized from a variety of carboxylic acids with 2-hydrazinopyridines in one simple step. The use of commercially available PS-PPh3 resin combined with microwave heating delivered the product triazolopyridines in good yields and purities.

  只需一个简单的步骤，即可从多种羧酸与2-肼基吡啶一起快速高效地合成三唑并吡啶。将可商购的PS-PPh 3树脂与微波加热结合使用，可以高收率和高纯度获得三唑并吡啶产物。