全氟-1,3-二甲基环己烷 | 335-27-3

• 物质功能分类: 有机原料 - 烃类化合物及其衍生物 - 烃类卤化物
• 分子结构分类: 有机化合物 - 有机卤素化合物 - 卤代烷
• 中文名称: 全氟-1,3-二甲基环己烷
• 中文别名: 全氟(1,3-二甲基环己胺)
• 英文名称: perfluoro-1,3-dimethylcyclohexane
• 英文别名: Perfluor-1,3-dimethylcyclohexan；1,1,2,2,3,3,4,5,5,6-decafluoro-4,6-bis(trifluoromethyl)cyclohexane
• CAS: 335-27-3
• 化学式: C₈F₁₆
• 分子量: 400.062
• InChiKey: LOQGSOTUHASIHI-UHFFFAOYSA-N

物化性质

• 熔点：
  -55 °C (lit.)
• 沸点：
  101-102 °C (lit.)
• 密度：
  1.828 g/mL at 25 °C (lit.)
• 蒸气密度：
  14 (vs air)
• 闪点：
  None
• LogP：
  666 at 25℃
• 保留指数：
  462

计算性质

• 辛醇/水分配系数(LogP)：
  5.4
• 重原子数：
  24
• 可旋转键数：
  0
• 环数：
  1.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  0
• 氢给体数：
  0
• 氢受体数：
  16

安全信息

• TSCA：
  T
• 危险品标志：
  Xi
• 危险类别码：
  R36/37/38
• WGK Germany：
  3
• RTECS号：
  GV4990000
• 海关编码：
  2903890090
• 安全说明：
  S26,S36
• 危险标志：
  GHS07
• 危险性描述：
  H315,H319,H335
• 危险性防范说明：
  P261,P305 + P351 + P338
• 储存条件：
  室温

SDS

Name:	Perfluoro-1 3-dimethylcyclohexane tech. 80% Material Safety Data Sheet
Synonym:	Hexadecafluoro-1,3-dimethylcyclohexane
CAS:	335-27-3

Section 1 - Chemical Product MSDS Name:Perfluoro-1 3-dimethylcyclohexane tech. 80% Material Safety Data Sheet
Synonym:Hexadecafluoro-1,3-dimethylcyclohexane

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Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS

CAS#	Chemical Name	content	EINECS#
335-27-3	Perfluoro-1,3-dimethylcyclohexane	80	206-386-9

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.The toxicological properties of this material have not been fully investigated.
Potential Health Effects
Eye:
Causes eye irritation.
Skin:
Causes skin irritation.
Ingestion:
May cause gastrointestinal irritation with nausea, vomiting and diarrhea. The toxicological properties of this substance have not been fully investigated.
Inhalation:
Causes respiratory tract irritation. The toxicological properties of this substance have not been fully investigated.
Chronic:
No information found.

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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 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. During a fire, irritating and highly toxic gases may be generated by thermal decomposition or combustion. Use water spray to keep fire-exposed containers cool. Use extinguishing media appropriate to the surrounding fire. Substance is noncombustible.
Vapors may be heavier than air. They can spread along the ground and collect in low or confined areas. Containers may explode when heated.
Extinguishing Media:
Substance is noncombustible; use agent most appropriate to extinguish 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:
Wash thoroughly after handling. Use with adequate ventilation. Avoid contact with eyes, skin, and clothing. Keep container tightly closed.
Avoid ingestion and inhalation. 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# 335-27-3: CAS# 7732-18-5: 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: Liquid
Color: colorless
Odor: Not available.
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: 101 - 102 deg C
Freezing/Melting Point: -55 deg C
Autoignition Temperature: Not available.
Flash Point: None
Explosion Limits, lower: Not available.
Explosion Limits, upper: Not available.
Decomposition Temperature:
Solubility in water:
Specific Gravity/Density: 1.8280g/cm3
Molecular Formula: C8F16
Molecular Weight: 400.06

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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, excess heat.
Incompatibilities with Other Materials:
Oxidizing agents.
Hazardous Decomposition Products:
Carbon monoxide, irritating and toxic fumes and gases, carbon dioxide, hydrogen fluoride gas.
Hazardous Polymerization: Has not been reported

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Section 11 - TOXICOLOGICAL INFORMATION
RTECS#:
CAS# 335-27-3 unlisted.
CAS# 7732-18-5: ZC0110000 LD50/LC50:
Not available.
CAS# 7732-18-5: Oral, rat: LD50 = >90 mL/kg.
Carcinogenicity:
Perfluoro-1,3-dimethylcyclohexane - Not listed by ACGIH, IARC, or NTP.
Water - Not listed by ACGIH, IARC, or NTP.
Other:
See actual entry in RTECS for complete information.

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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 28A After contact with skin, wash immediately with
plenty of water.
S 37 Wear suitable gloves.
S 37/39 Wear suitable gloves and eye/face
protection.
S 45 In case of accident or if you feel unwell, seek
medical advice immediately (show the label where
possible).
WGK (Water Danger/Protection)
CAS# 335-27-3: No information available.
CAS# 7732-18-5: No information available.
Canada
CAS# 335-27-3 is listed on Canada's NDSL List.
CAS# 7732-18-5 is listed on Canada's DSL List.
CAS# 335-27-3 is not listed on Canada's Ingredient Disclosure List.
CAS# 7732-18-5 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 335-27-3 is listed on the TSCA inventory.
CAS# 7732-18-5 is listed on the TSCA inventory.

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SECTION 16 - ADDITIONAL INFORMATION
N/A

制备方法与用途

Perfluoro-1,3-dimethylcyclohexane是一种用于通过等离子体聚合制备无定形氟碳薄膜的合成试剂，同时也是线性终端烯烃水合法的重要原料。作为一种化学性质稳定、类似于其他全氟化碳化合物的分支环己烷衍生物，它还因其能够在极低浓度下被检测到而成为理想的追踪标记物，适用于其他氟碳化合物的跟踪研究。

反应信息

• 作为反应物：
  描述：

  全氟-1,3-二甲基环己烷 在 氨 、 汞 作用下， 以30%的产率得到2-Amino-4,4,5,5-tetrafluoro-6-imino-3-trifluoromethyl-cyclohex-2-enecarbonitrile
  参考文献：
  名称：

  Burdeniuc, Juan; Chupka, William; Crabtree, Robert H., Journal of the American Chemical Society, 1995, vol. 117, # 40, p. 10119 - 10120

  摘要：

  DOI：
• 作为产物：
  描述：

  间二三氟甲苯 在 cobalt (III) fluoride 、 氮气 作用下， 生成 全氟-1,3-二甲基环己烷
  参考文献：
  名称：

  中试植物合成-全氟正庚烷，全氟二甲基环己烷和高沸点碳氟化合物油

  摘要：

  DOI：

  10.1021/ie50447a618

文献信息

• [EN] CATALYSTS<br/>[FR] CATALYSEURS
  申请人：BOREALIS AG

  公开号：WO2018091684A1

  公开（公告）日：2018-05-24

  A complex of formula (I) wherein M is zirconium or hafnium; each X independently is a sigma ligand; L is a divalent bridge selected from -R'2C-, -R'2C-CR'2-, -R'2Si-, -R'2Si-SiR'2-, -R'2Ge-, wherein each R' is independently a hydrogen atom or a C1-C20-hydrocarbyl group optionally containing one or more silicon atoms or heteroatoms of Group 14-16 of the periodic table or fluorine atoms, and optionally two R' groups taken together can form a ring; R2 and R2' are each independently a C1-C20 hydrocarbyl group, -OC1- hydrocarbyl group or -SC1-20 hydrocarbyl group; R5 is a -OC1-20 hydrocarbyl group or -SC1-20 hydrocarbyl group, said R5 group being optionally substituted by one or more halo groups; R5' is hydrogen or a C1-20 hydrocarbyl group; -OC1-20 hydrocarbyl group or -SC1-20 hydrocarbyl group; said C1-20 hydrocarbyl group being optionally substituted by one or more halo groups; R6 and R6' are each independently a C1-20 hydrocarbyl group; -OC1-20 hydrocarbyl group or -SC1-20 hydrocarbyl group; each R1 and R1' are independently -CH2Rx wherein Rx are each independently H, or a C1-20 hydrocarbyl group, optionally containing heteroatoms.

  式中M为锆或铪；每个X独立地是一个σ配体；L是一个二价桥，选自-R'2C-、-R'2C-CR'2-、-R'2Si-、-R'2Si-SiR'2-、-R'2Ge-，其中每个R'独立地是一个氢原子或一个C1-C20的烃基团，可选地包含一个或多个硅原子或周期表中第14-16族的杂原子或氟原子，并且可选地两个R'基团一起可以形成一个环；R2和R2'各自独立地是一个C1-C20烃基团、-OC1-烃基团或-SC1-20烃基团；R5是一个-OC1-20烃基团或-SC1-20烃基团，所述R5基团可被一个或多个卤素取代；R5'是氢或一个C1-20烃基团；-OC1-20烃基团或-SC1-20烃基团；所述C1-20烃基团可被一个或多个卤素取代；R6和R6'各自独立地是一个C1-20烃基团；-OC1-20烃基团或-SC1-20烃基团；每个R1和R1'各自独立地为-CH2Rx，其中Rx各自独立地为H，或一个C1-20烃基团，可选地含有杂原子。
• [EN] PROCESS FOR PREPARING PROPYLENE COPOLYMERS COMPRISING C4-C12-ALPHA OLEFIN COMONOMER UNITS<br/>[FR] PROCÉDÉ DE PRÉPARATION DE COPOLYMÈRES DE PROPYLÈNE COMPRENANT DES UNITÉS COMONOMÈRES D'ALPHA-OLÉFINES C4-C12
  申请人：BOREALIS AG

  公开号：WO2019215122A1

  公开（公告）日：2019-11-14

  The present invention relates to a process for producing a copolymer of propylene, optionally ethylene, and at least one comonomer selected from alpha olefins having from 4 to 12 carbon atoms using a specific class of metallocene complexes in combination with a cocatalyst system comprising a boron containing cocatalyst and an aluminoxane cocatalyst, preferably in a multistage polymerization process including a gas phase polymerization step.

  本发明涉及一种使用特定类别的茂金属络合物与含有硼的共催化剂和铝氧烷共催化剂的共催化剂系统相结合的过程，用于生产丙烯、可选的乙烯和至少一种选自具有4到12个碳原子的α-烯烃的共单体的共聚物，优选采用包括气相聚合步骤的多阶段聚合过程。
• Synthesis and characterization of cyclodextrin/perfluoroalkane inclusion compounds
  作者：J.D. Druliner、E. Wasserman

  DOI：10.1016/0022-1139(94)03179-4

  日期：1995.5

  β-cyclodextrins (CD) in aqueous solution to varying extents, depending on the structure of both the perfluoroalkane and the cyclodextrin. β-CD readily forms insoluble inclusion compounds, including a β-CD/C9F19· complex, prepared from the stable perfluoro-1-ethyl-1,1-diisopropylmethyl radical. Under similar conditions, only trace amounts of inclusion compounds were obtained using α-CD solutions. Three hydrocarbons

  根据全氟烷烃和环糊精的结构，无环和环状全氟烷烃与水溶液中的α-和β-环糊精（CD）结合程度不同。β-CD容易形成不溶性包合物，包括由稳定的全氟-1-乙基-1,1-二异丙基甲基基团制得的β-CD/ C 9 F 19 ·配合物。在相似的条件下，使用α-CD溶液只能获得痕量的夹杂物。将三种碳氢化合物与相应的全氟化碳形成α-CD和β-CD夹杂物的趋势进行了比较。
• NITRILEOXIDE COMPOUND
  申请人：DAIKIN INDUSTRIES, LTD.

  公开号：US20180050983A1

  公开（公告）日：2018-02-22

  The present invention provides a compound of the formula (I): wherein, R 1 is a hydrogen atom or a hydrocarbon group; R 2 is —R 4 —R 5 ; R 3 is —R 4 —R 5 or —R 4 —R 6 ; R 4 is a divalent organic group; R 5 is OH, SH, COOH or NHR 9 ; R 9 is a hydrogen atom or an alkyl group having 1-6 carbon atoms; and R 6 is a hydrogen atom or an alkyl group having 1-6 carbon atoms.

  本发明提供了一种具有以下式（I）的化合物：其中，R1是氢原子或烃基；R2是—R4—R5；R3是—R4—R5或—R4—R6；R4是二价有机基；R5是OH、SH、COOH或NHR9；R9是氢原子或具有1-6个碳原子的烷基基团；R6是氢原子或具有1-6个碳原子的烷基基团。
• Method of oxidizing an alcohol using a recyclable fluorous sulfoxide
  申请人：——

  公开号：US20030105363A1

  公开（公告）日：2003-06-05

  A method of oxidizing primary and secondary alcohols to an aldehyde or ketone using a fluorous sulfoxide or a fluorous sulfide is disclosed. The method includes regenerating and recycling the fluorous sulfoxide.

  揭示了一种利用氟烃亚砜或氟烃硫化物将一级和二级醇氧化为醛或酮的方法。该方法包括再生和循环利用氟烃亚砜。

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