1-三甲基苯磺酰基-1,2,4-三唑 | 54230-59-0

• 物质功能分类: 医药中间体 - 原料药中间体
• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 中文名称: 1-三甲基苯磺酰基-1,2,4-三唑
• 中文别名: 1-三甲基苯磺酰基-1H-1,2,4-三唑
• 英文名称: 1-(mesitylen-2-sulfonyl)-1H-1,2,4-triazole
• 英文别名: 1-(Mesitylensulfonyl)-(1H)-1,2,4-triazol；1-(2,4,6-trimethyl-benzenesulfonyl)-1H-[1,2,4]triazole；1-(2-mesitylenesulfonyl)-1H-1,2,4-triazole；1-(2-mesitylenesulfonyl)-1,2,4-triazole；mesityl 1,2,4-triazole-1-sulfonate；1-(Mesitylsulfonyl)-1H-1,2,4-triazole；1-(2,4,6-trimethylphenyl)sulfonyl-1,2,4-triazole
• CAS: 54230-59-0
• 化学式: C₁₁H₁₃N₃O₂S
• mdl: MFCD00003097
• 分子量: 251.309
• InChiKey: XNKYPZJMRHXJJQ-UHFFFAOYSA-N

物化性质

• 熔点：
  134-135°C
• 密度：
  1.31
• 稳定性/保质期：

  遵照规定使用和储存，则不会分解。

计算性质

• 辛醇/水分配系数(LogP)：
  2.3
• 重原子数：
  17
• 可旋转键数：
  2
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.272
• 拓扑面积：
  73.2
• 氢给体数：
  0
• 氢受体数：
  4

安全信息

• 危险品标志：
  Xi
• 危险类别码：
  R36/37/38
• 海关编码：
  2933990090
• 安全说明：
  S26,S36
• 危险性防范说明：
  P261,P280,P301+P312,P302+P352,P305+P351+P338
• 危险性描述：
  H302,H315,H319,H335

SDS

Name:	1-(2-Mesitylsulfonyl)-1H-1 2 4-triazole 99% Material Safety Data Sheet
Synonym:	Mesityl 1,2,4-triazole-1-sulphonat
CAS:	54230-59-0

Section 1 - Chemical Product MSDS Name:1-(2-Mesitylsulfonyl)-1H-1 2 4-triazole 99% Material Safety Data Sheet
Synonym:Mesityl 1,2,4-triazole-1-sulphonat

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Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS

CAS#	Chemical Name	content	EINECS#
54230-59-0	1-(2-Mesitylsulfonyl)-1H-1,2,4-triazol	99	259-034-1

Hazard Symbols: XI
Risk Phrases: 36/37/38

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Section 3 - HAZARDS IDENTIFICATION
EMERGENCY OVERVIEW
Irritating to eyes, respiratory system and skin.
Potential Health Effects
Eye:
Causes eye irritation. May cause chemical conjunctivitis.
Skin:
Causes skin irritation.
Ingestion:
May cause gastrointestinal irritation with nausea, vomiting and diarrhea.
Inhalation:
Causes respiratory tract irritation. Can produce delayed pulmonary edema.
Chronic:
Effects may be delayed.

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Section 4 - FIRST AID MEASURES
Eyes: Immediately 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. Wash clothing before reuse.
Ingestion:
Never give anything by mouth to an unconscious person. Get medical aid. Do NOT induce vomiting. If conscious and alert, rinse mouth and drink 2-4 cupfuls of milk or 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. Do NOT use mouth-to-mouth resuscitation.
Notes to Physician:
Treat symptomatically and supportively.

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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. During a fire, irritating and highly toxic gases may be generated by thermal decomposition or combustion.
Extinguishing Media:
Use water spray, dry chemical, carbon dioxide, or appropriate foam.

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Section 6 - ACCIDENTAL RELEASE MEASURES
General Information: Use proper personal protective equipment as indicated in Section 8.
Spills/Leaks:
Sweep up, then place into a suitable container for disposal. Avoid generating dusty conditions. Provide ventilation.

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Section 7 - HANDLING and STORAGE
Handling:
Wash thoroughly after handling. Remove contaminated clothing and wash before reuse. Minimize dust generation and accumulation. Avoid contact with eyes, skin, and clothing. Avoid ingestion and inhalation. Use with adequate ventilation.
Storage:
Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances. Deep freeze (below -20C).

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Section 8 - EXPOSURE CONTROLS, PERSONAL PROTECTION
Engineering Controls:
Facilities storing or utilizing this material should be equipped with an eyewash facility and a safety shower. Use adequate ventilation to keep airborne concentrations low.
Exposure Limits CAS# 54230-59-0: Personal Protective Equipment Eyes: Wear appropriate protective eyeglasses or chemical safety goggles as described by OSHA's eye and face protection regulations in 29 CFR 1910.133 or European Standard EN166.
Skin:
Wear appropriate protective gloves to prevent skin exposure.
Clothing:
Wear appropriate protective clothing to prevent skin exposure.
Respirators:
A respiratory protection program that meets OSHA's 29 CFR 1910.134 and ANSI Z88.2 requirements or European Standard EN 149 must be followed whenever workplace conditions warrant respirator use.

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Section 9 - PHYSICAL AND CHEMICAL PROPERTIES

Physical State: Powder
Color: white
Odor: None reported.
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: Not available.
Freezing/Melting Point: 134.00 - 136.00 deg C
Autoignition Temperature: Not applicable.
Flash Point: Not applicable.
Explosion Limits, lower: Not available.
Explosion Limits, upper: Not available.
Decomposition Temperature: Not available.
Solubility in water: Not available.
Specific Gravity/Density: Not available.
Molecular Formula: C11H13N3O2S
Molecular Weight: 251.31

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Section 10 - STABILITY AND REACTIVITY
Chemical Stability:
Stable at room temperature in closed containers under normal storage and handling conditions.
Conditions to Avoid:
Incompatible materials, dust generation, excess heat, strong oxidants.
Incompatibilities with Other Materials:
Bases, oxidizing agents.
Hazardous Decomposition Products:
Nitrogen oxides, carbon monoxide, oxides of sulfur, irritating and toxic fumes and gases, carbon dioxide, nitrogen.
Hazardous Polymerization: Has not been reported.

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Section 11 - TOXICOLOGICAL INFORMATION
RTECS#:
CAS# 54230-59-0 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
1-(2-Mesitylsulfonyl)-1H-1,2,4-triazole - 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
Not regulated as a hazardous material.
IMO
Not regulated as a hazardous material.
RID/ADR
Not regulated as a hazardous material.

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Section 15 - REGULATORY INFORMATION

European/International Regulations
European Labeling in Accordance with EC Directives
Hazard Symbols: XI
Risk Phrases:
R 36/37/38 Irritating to eyes, respiratory system
and skin.
Safety Phrases:
S 24/25 Avoid contact with skin and eyes.
WGK (Water Danger/Protection)
CAS# 54230-59-0: No information available.
Canada
None of the chemicals in this product are listed on the DSL/NDSL list.
CAS# 54230-59-0 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 54230-59-0 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

用途

1-三甲基苯磺酰基-1,2,4-三唑是一种杂环有机化合物，可用作医药中间体。

文献信息

• METHOD FOR PREPARING OLIGONUCLEOTIDE
  申请人：Xi Zhen

  公开号：US20110237786A1

  公开（公告）日：2011-09-29

  A method for preparing oligonucleotide comprising reacting the compound of Formula (1) with the compound of Formula (2) in a liquid reaction medium under the condition of condensation reaction to obtain the compound of formula (3). In the method according to the present invention, the functional groups are protected by suitable protective groups to only expose the 5′-OH of the compound of Formula (1) (OH-component) and the 3′-phosphate of the compound of Formula (2) (P-component) which are to be connected, so that the condensation reaction is carried out in a liquid reaction medium to bond the OH-component and P-component to obtain DNA or RNA short chain. The method of the present invention does not need a solid phase column and can be carried out in a liquid reaction medium. Thus, oligonucleotides can be synthesized on a large scale.

  一种制备寡核苷酸的方法，包括在液体反应介质中，将化合物式（1）与化合物式（2）在缩合反应条件下反应，以获得化合物式（3）。根据本发明的方法，通过适当的保护基保护功能基团，仅暴露化合物式（1）的5'-OH（OH组分）和化合物式（2）的3'-磷酸酯（P组分），这两者将被连接，从而在液体反应介质中进行缩合反应，将OH组分和P组分连接以获得DNA或RNA短链。本发明的方法不需要固相柱，并且可以在液体反应介质中进行。因此，寡核苷酸可以大规模合成。
• [EN] INHIBITORS OF 11-BETA-HYDROXY STEROID DEHYDROGENASE TYPE I<br/>[FR] INHIBITEURS DE 11-BETA-HYDROXY STEROIDE DESHYDROGENASE DE TYPE I
  申请人：BIOVITRUM AB

  公开号：WO2004103980A1

  公开（公告）日：2004-12-02

  The present invention relates to compounds with the formula (I) and also to pharmaceutical compositions comprising the compounds, as well as to the use of the compounds in medicine and for the preparation of a medicament which acts on the human 11-β-hydroxysteroid dehydrogenase type 1 enzyme.

  本发明涉及具有化学式(I)的化合物，以及包含这些化合物的药物组合物，还涉及这些化合物在医学中的应用，以及用于制备对人类11-β-羟基类固醇脱氢酶类型1酶起作用的药物的药物。
• Inhibitors of 11-beta-hydroxy steroid dehydrogenase type 1
  申请人：Pyring David

  公开号：US20050009821A1

  公开（公告）日：2005-01-13

  The present invention relates to compounds with the formula (I) and also to pharmaceutical compositions comprising the compounds, as well as to the use of the compounds in medicine and for the preparation of a medicament which acts on the human 11-β-hydroxysteroid dehydrogenase type 1 enzyme.

  本发明涉及具有公式(I)的化合物，以及包括这些化合物的制药组合物，以及这些化合物在医学上的使用和用于制备作用于人类11-β-羟基类固醇脱氢酶1型酶的药物。
• Ihibitors of 11-beta-hydroxy steroid dehydrogenase type 1
  申请人：Pyring David

  公开号：US20070066614A1

  公开（公告）日：2007-03-22

  The present invention relates to compounds with the formula (I) and also to pharmaceutical compositions comprising the compounds, as well as to the use of the compounds in medicine and for the preparation of a medicament which acts on the human 11-β-hydroxysteroid dehydrogenase type 1 enzyme.

  本发明涉及具有式(I)的化合物，以及包含这些化合物的制药组合物，还涉及这些化合物在医学中的使用以及用于制备作用于人类11-β-羟基类固醇脱氢酶1型酶的药物。
• Coating composition for interconnection part of electrode and plasma display panel including the same
  申请人：Samsung SDI Co., Ltd.

  公开号：EP2014797A2

  公开（公告）日：2009-01-14

  Provided are a coating composition for an interconnection part of an electrode and a plasma display panel including the same. Specifically, the coating composition for an interconnection part of an electrode, comprising 0.05 to 2.0 parts by weight of a compound containing a triazole group, 3.5 to 7.5 parts by weight of a silane based compound, and 0.5 to 2.0 parts by weight of a transition metal oxide, is used to effectively prevent opens and short circuits of an electrode due to damage of an interconnection unit caused by gases and humidity in the surrounding environment and due to a migration phenomenon.

  本发明提供了一种用于电极互连部分的涂层组合物以及包括该组合物的等离子显示面板。具体来说，电极互连部分的涂层组合物由 0.05 至 2.0 份（按重量计）含三唑基团的化合物、3.5 至 7.5 份（按重量计）硅烷基化合物和 0.5 至 2.0 份（按重量计）过渡金属氧化物组成，用于有效防止因周围环境中的气体和湿度以及迁移现象造成互连单元损坏而导致的电极开路和短路。

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