2-(4-氨基苯)-1,1,1,3,3,3-六氟-2-丙醇 | 722-92-9

• 物质功能分类: 有机原料 - 氨基化合物 - 含氧基氨基化合物
• 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: 2-(4-氨基苯)-1,1,1,3,3,3-六氟-2-丙醇
• 中文别名: 4-(六氟-2-羟基异丙基)苯胺；2-(4-氨基苯基)-1,1,1,3,3,3-六氟-2-丙醇
• 英文名称: 2-(4-aminophenyl)-1,1,1,3,3,3-hexafluoro-2-propanol
• 英文别名: 2-(4-aminophenyl)-1,1,1,3,3,3-hexafluoropropan-2-ol；4-(1-hydroxy-1-trifluoromethyl-2,2,2-trifluoroethyl)aniline；4--anilin；p-Amino-α,α-bis-(trifluormethyl)-benzylalkohol；4-[2,2,2-trifluoro-1-hydroxy-1-(trifluoromethyl)ethyl]phenylamine
• CAS: 722-92-9
• 化学式: C₉H₇F₆NO
• mdl: MFCD00039258
• 分子量: 259.151
• InChiKey: TZEJXCIGVMTMDY-UHFFFAOYSA-N

物化性质

• 熔点：
  147-152 °C
• 沸点：
  292.9±40.0 °C(Predicted)
• 密度：
  1.505±0.06 g/cm3(Predicted)
• 稳定性/保质期：

  常温常压下稳定，避免与氧化物接触。

计算性质

• 辛醇/水分配系数(LogP)：
  2.7
• 重原子数：
  17
• 可旋转键数：
  1
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.333
• 拓扑面积：
  46.2
• 氢给体数：
  2
• 氢受体数：
  8

安全信息

• 危险等级：
  IRRITANT
• 危险等级：
  6.1
• 危险品标志：
  Xi
• 安全说明：
  S26,S36/37/39
• 危险类别码：
  R20/22,R36/37/38
• 海关编码：
  2922199090
• 危险性防范说明：
  P261,P305+P351+P338
• 危险性描述：
  H302,H315,H319,H335
• 储存条件：
  请将容器密封后，放入一个紧密封装的储存器中，并存放在阴凉、干燥的地方。

SDS

Name:	2-(4-Aminophenyl)-1 1 1 3 3 3-hexafluoro-2 -propanol Material Safety Data Sheet
Synonym:	4-(Hexafluoro-2-hydroxyisopropyl)anilin
CAS:	722-92-9

Section 1 - Chemical Product MSDS Name:2-(4-Aminophenyl)-1 1 1 3 3 3-hexafluoro-2 -propanol Material Safety Data Sheet
Synonym:4-(Hexafluoro-2-hydroxyisopropyl)anilin

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Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS

CAS#	Chemical Name	content	EINECS#
722-92-9	2-(4-Aminophenyl)-1,1,1,3,3,3-hexafluo		unlisted

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.
Skin:
Causes skin irritation. May be harmful if absorbed through the skin.
Ingestion:
May cause irritation of the digestive tract. May be harmful if swallowed.
Inhalation:
Causes respiratory tract irritation. May be harmful if inhaled.
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:
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.
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:
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# 722-92-9: 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: Not available.
Odor: Not available.
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: Not available.
Freezing/Melting Point: 155 - 156 deg C
Autoignition Temperature: Not available.
Flash Point: Not available.
Explosion Limits, lower: Not available.
Explosion Limits, upper: Not available.
Decomposition Temperature:
Solubility in water:
Specific Gravity/Density:
Molecular Formula: C9H7F6NO
Molecular Weight: 259.15

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

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Section 11 - TOXICOLOGICAL INFORMATION
RTECS#:
CAS# 722-92-9 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
2-(4-Aminophenyl)-1,1,1,3,3,3-hexafluoro-2 -propanol - 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 26 In case of contact with eyes, rinse immediately
with plenty of water and seek medical advice.
S 37/39 Wear suitable gloves and eye/face
protection.
WGK (Water Danger/Protection)
CAS# 722-92-9: No information available.
Canada
None of the chemicals in this product are listed on the DSL/NDSL list.
CAS# 722-92-9 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 722-92-9 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

2-(4-氨基苯基)-1,1,1,3,3,3-六氟-2-丙醇可用来制备双酚AF。双酚AF（即六氟双酚A：2,2-双(4-羟基苯基)六氟丙烷），主要用于作为氟橡胶硫化促进剂。

制备

在四颈瓶中，将0.02摩尔对甲苯磺酸加入到0.1摩尔苯胺中，并用氮气置换。加热至一定温度后，在搅拌下缓慢滴加0.3摩尔HFA·3H₂O（约需30分钟滴加完毕）。滴加完成后，继续在110℃回流8小时后停止反应，冷却至室温凝结成白色固体。加入乙醚溶解，过滤并洗涤滤液。将滤液通过旋转蒸发去除乙醚及其他低沸点物质，并进行干燥处理，最终得到2-(4-氨基苯基)-1,1,1,3,3,3-六氟-2-丙醇粗品。该方法的收率为90.2％（通过GC-MS测定），纯度达到97.9％。