1-(3-氟苯基)环戊甲腈 | 214262-90-5

• 物质功能分类: 有机原料 - 有机氟化合物 - 氟苯腈系列
• 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-(3-氟苯基)环戊甲腈
• 中文别名: 1-(3-氟苯基)环戊腈
• 英文名称: 1-(3-Fluorophenyl)cyclopentanecarbonitrile
• 英文别名: 1-(3-fluorophenyl)cyclopentane-1-carbonitrile
• CAS: 214262-90-5
• 化学式: C₁₂H₁₂FN
• 分子量: 189.23
• InChiKey: GJLHAOFLBRWFJM-UHFFFAOYSA-N

物化性质

• 沸点：
  312.5±35.0 °C(Predicted)
• 密度：
  1.0913 (estimate)
• 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)：
  3.1
• 重原子数：
  14
• 可旋转键数：
  1
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.42
• 拓扑面积：
  23.8
• 氢给体数：
  0
• 氢受体数：
  2

安全信息

• 海关编码：
  29269095,2926909090

SDS

Name:	1-(3-Fluorophenyl)cyclopentanecarbonitrile 99% Material Safety Data Sheet
Synonym:	None
CAS:	214262-90-5

Section 1 - Chemical Product MSDS Name:1-(3-Fluorophenyl)cyclopentanecarbonitrile 99% Material Safety Data Sheet
Synonym:None

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Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS

CAS#	Chemical Name	content	EINECS#
214262-90-5	1-(3-Fluorophenyl)cyclopentanecarbonit	99	unlisted

Hazard Symbols: XN
Risk Phrases: 20/21/22 36/37/38

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Section 3 - HAZARDS IDENTIFICATION
EMERGENCY OVERVIEW
Harmful by inhalation, in contact with skin and if swallowed.
Irritating to eyes, respiratory system and skin.
Potential Health Effects
Eye:
Causes eye irritation. May cause chemical conjunctivitis.
Skin:
Causes skin irritation. Harmful if absorbed through the skin. May be metabolized to cyanide which in turn acts by inhibiting cytochrome oxidase impairing cellular respiration.
Ingestion:
Harmful if swallowed. May cause gastrointestinal irritation with nausea, vomiting and diarrhea. The toxicological properties of this substance have not been fully investigated. Metabolism may release cyanide, which may result in headache, dizziness, weakness, collapse, unconsciousness and possible death.
Inhalation:
Harmful if inhaled. Causes respiratory tract irritation. Can produce delayed pulmonary edema. May be metabolized to cyanide which in turns act by inhibiting cytochrome oxidase impairing cellular respiration.
Chronic:
May be metabolized to cyanide which in turn acts by inhibiting cytochrome oxidase impairing cellular respiration. Effects may be delayed. Chronic exposure to cyanide solutions may lead to the development of a "cyanide" rash, characterized by itching, and by macular, papular, and vesicular eruptions, and may be accompanied by secondary infections. Exposure to small amounts of cyanide compounds over long periods of time is reported to cause loss of appetite, headache, weakness, nausea, dizziness, and symptoms of irritation of the upper respiratory tract and eyes.

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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. Wash mouth out with water.
Inhalation:
Remove from exposure and move to fresh air immediately. If breathing is difficult, give oxygen. Get medical aid. Do NOT use mouth-to-mouth resuscitation. If breathing has ceased apply artificial respiration using oxygen and a suitable mechanical device such as a bag and a mask.
Notes to Physician:
Treat symptomatically and supportively. May be partially metabolized to cyanide in the body.
Antidote: Always have a cyanide antidote kit on hand when working with cyanide compounds. Get medical advice to use.

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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. Vapors may be heavier than air. They can spread along the ground and collect in low or confined areas. Runoff from fire control or dilution water may cause pollution.
Extinguishing Media:
Use water spray to cool fire-exposed containers. Use extinguishing media most appropriate for the surrounding fire. 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:
Absorb spill with inert material (e.g. vermiculite, sand or earth), then place in suitable container. Avoid runoff into storm sewers and ditches which lead to waterways. Clean up spills immediately, observing precautions in the Protective Equipment section. Provide ventilation.

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Section 7 - HANDLING and STORAGE
Handling:
Avoid breathing dust, vapor, mist, or gas. Avoid contact with eyes, skin, and clothing. Keep container tightly closed. Avoid ingestion and inhalation. Use with adequate ventilation. Wash clothing before reuse.
Storage:
Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances.

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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# 214262-90-5: Personal Protective Equipment Eyes: Wear chemical splash goggles.
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: Liquid
Color: slightly yellow - clear pale yellow
Odor: Not available.
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: Not available.
Freezing/Melting Point: Not available.
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: C12H12FN
Molecular Weight: 189.09

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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:
Excess heat.
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# 214262-90-5 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
1-(3-Fluorophenyl)cyclopentanecarbonitrile - 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: Not regulated.
Hazard Class:
UN Number:
Packing Group:
IMO
Shipping Name: Not regulated.
Hazard Class:
UN Number:
Packing Group:
RID/ADR
Shipping Name: Not regulated.
Hazard Class:
UN Number:
Packing group:

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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.
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 36/37/39 Wear suitable protective clothing, gloves
and eye/face protection.
WGK (Water Danger/Protection)
CAS# 214262-90-5: No information available.
Canada
None of the chemicals in this product are listed on the DSL/NDSL list.
CAS# 214262-90-5 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 214262-90-5 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

文献信息

• Process for preparing zeolites
  申请人：——

  公开号：US20020085976A1

  公开（公告）日：2002-07-04

  The present invention relates to a process for preparing zeolites using quaternary ammonium cations having the following formula as structure directing agents: 1 wherein: X is —H, methyl, —F, —Cl, —F and —Cl, or methoxy; R 1 and R 2 are each methyl or ethyl; R 1 and R 2 together are —(CH 2 ) x — where x is 2, 3, 4, or 5; or R 1 and R 2 together are methylated or dimethylated —(CH 2 ) y — where y is 3, 4, or 5; and R 3 , R 4 and R 5 are each methyl or ethyl, or one of R 3 , R 4 or R 5 is methyl and the other two together are —(CH 2 ) z — where z is 4, 5, 6 or 7;.

  本发明涉及一种使用季铵阳离子作为结构导向剂制备沸石的方法，所述季铵阳离子具有以下公式：1其中：X为—H、甲基、—F、—Cl、—F和—Cl、或甲氧基；R1和R2均为甲基或乙基；R1和R2在一起为—(CH2)x—，其中x为2、3、4或5；或者R1和R2在一起为甲基化或二甲基化的—( )y—，其中y为3、4或5；而且R3、R4和R5均为甲基或乙基，或者R3、R4或R5之一为甲基，而另外两个在一起为—( )z—，其中z为4、5、6或7。
• Zeolite SSZ-53
  申请人：——

  公开号：US20020104780A1

  公开（公告）日：2002-08-08

  The present invention relates to a new crystalline zeolite SSZ-53 prepared by using phenylcycloalkylmethyl ammonium cations as structure directing agents.

  本发明涉及一种以苯基环烷基甲基铵阳离子为结构引导剂制备的新型结晶沸石 SSZ-53。
• ZEOLITE SSZ-53 FOR REDUCTION OF NITROGEN IN A GAS STREAM
  申请人：Chevron U.S.A. Inc.

  公开号：US20040106511A1

  公开（公告）日：2004-06-03

  The present invention relates to a new crystalline zeolite SSZ-53 prepared by using phenylcycloalkylmethyl ammonium cations as structure directing agents.

  本发明涉及一种以苯基环烷基甲基铵阳离子为结构引导剂制备的新型结晶沸石 SSZ-53。
• ZEOLITE SSZ-53
  申请人：Chevron U.S.A. Inc.

  公开号：EP1289885A1

  公开（公告）日：2003-03-12
• THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURO DEGENERATIVE DISEASES
  申请人：NV reMYND

  公开号：EP1981504B1

  公开（公告）日：2010-07-21