叔丁基4-乙烯基苯基碳酸酯 | 87188-51-0

• 物质功能分类: 化学试剂 - 有机试剂 - 烯烃（环状与无环状）
• 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: 叔丁基4-乙烯基苯基碳酸酯
• 中文别名: 4-乙烯基苯基碳酸叔丁酯
• 英文名称: para-tert-butoxycarbonyloxystyrene
• 英文别名: tert-butyl 4-vinylphenyl carbonate；p-(tert-butoxycarbonyloxy)styrene；t-butyl 4-vinylphenyl carbonate；t-BOC-styrene；4-tert-butoxycarbonyloxystyrene；4-tertiarybutoxycarbonyloxystyrene；Carbonic acid, 1,1-dimethylethyl 4-ethenylphenyl ester；tert-butyl (4-ethenylphenyl) carbonate
• CAS: 87188-51-0
• 化学式: C₁₃H₁₆O₃
• mdl: MFCD00145182
• 分子量: 220.268
• InChiKey: GJWMYLFHBXEWNZ-UHFFFAOYSA-N

物化性质

• 熔点：
  27-29 °C(lit.)
• 沸点：
  187 °C(lit.)
• 密度：
  1.1101 (rough estimate)
• 闪点：
  >230 °F
• 稳定性/保质期：
  如果按照规格使用和储存，则不会分解，且没有已知的危险反应。

计算性质

• 辛醇/水分配系数(LogP)：
  3.8
• 重原子数：
  16
• 可旋转键数：
  5
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.307
• 拓扑面积：
  35.5
• 氢给体数：
  0
• 氢受体数：
  3

安全信息

• 危险性防范说明：
  P264,P280,P302+P352,P337+P313,P305+P351+P338,P362+P364,P332+P313
• 危险性描述：
  H315,H319

SDS

Name:	p-tert-Butoxycarbonyloxystyrene Material Safety Data Sheet
Synonym:	None
CAS:	87188-51-0

Section 1 - Chemical Product MSDS Name:p-tert-Butoxycarbonyloxystyrene Material Safety Data Sheet
Synonym:None

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Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS

CAS#	Chemical Name	content	EINECS#
87188-51-0	p-tert-Butoxycarbonyloxystyrene	100.0	unlisted

Hazard Symbols: None Listed.
Risk Phrases: None Listed.

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Section 3 - HAZARDS IDENTIFICATION
EMERGENCY OVERVIEW
The toxicological properties of this material have not been fully investigated.
Potential Health Effects
Eye:
May cause eye irritation.
Skin:
May cause skin irritation.
Ingestion:
May cause irritation of the digestive tract. The toxicological properties of this substance have not been fully investigated.
Inhalation:
May cause 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: Flush eyes with plenty of water for at least 15 minutes, occasionally lifting the upper and lower eyelids. Get medical aid immediately.
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:
If victim is conscious and alert, give 2-4 cupfuls of milk or water.
Never give anything by mouth to an unconscious person. Get medical aid immediately.
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:
Antidote: None reported.

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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:
Clean up spills immediately, observing precautions in the Protective Equipment section. Sweep up or absorb material, then place into a suitable clean, dry, closed container for disposal. Provide ventilation.

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Section 7 - HANDLING and STORAGE
Handling:
Wash thoroughly after handling. Remove contaminated clothing and wash before reuse. Use with adequate ventilation. Avoid contact with eyes, skin, and clothing. Keep container tightly closed. Avoid ingestion and inhalation.
Storage:
Keep container closed when not in use. Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances. Keep refrigerated. (Store below 4C/39F.)

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Section 8 - EXPOSURE CONTROLS, PERSONAL PROTECTION
Engineering Controls:
Use adequate ventilation to keep airborne concentrations low.
Exposure Limits CAS# 87188-51-0: 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:
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: Not available.
Odor: Not available.
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: 187 deg C @ 760.00mm Hg
Freezing/Melting Point: 27 - 29 deg C
Autoignition Temperature: Not available.
Flash Point: > 110 deg C (> 230.00 deg F)
Explosion Limits, lower: N/A
Explosion Limits, upper: N/A
Decomposition Temperature:
Solubility in water:
Specific Gravity/Density:
Molecular Formula: C13H16O3
Molecular Weight: 220.27

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Section 10 - STABILITY AND REACTIVITY
Chemical Stability:
Stable under normal temperatures and pressures.
Conditions to Avoid:
Incompatible materials, strong oxidants.
Incompatibilities with Other Materials:
Oxidizing agents.
Hazardous Decomposition Products:
Irritating and toxic fumes and gases.
Hazardous Polymerization: Has not been reported

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Section 11 - TOXICOLOGICAL INFORMATION
RTECS#:
CAS# 87188-51-0: FG0460000 LD50/LC50:
CAS# 87188-51-0: Draize test, rabbit, skin: 500 uL Mild; Skin, rabbit: LD50 = >2 gm/kg.
Carcinogenicity:
p-tert-Butoxycarbonyloxystyrene - Not listed by ACGIH, IARC, or NTP.
Other:
See actual entry in RTECS for complete information.

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Section 12 - ECOLOGICAL INFORMATION
Other No information available.

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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: Not available.
Risk Phrases:
Safety Phrases:
S 24/25 Avoid contact with skin and eyes.
S 28A After contact with skin, wash immediately with
plenty of water.
S 37 Wear suitable gloves.
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# 87188-51-0: No information available.
Canada
None of the chemicals in this product are listed on the DSL/NDSL list.
CAS# 87188-51-0 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 87188-51-0 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

反应信息

• 作为反应物：
  描述：

  叔丁基4-乙烯基苯基碳酸酯 在 palladium diacetate 、 sodium hydroxide 、 sodium methylate 、 三乙胺 、 三(邻甲基苯基)磷 作用下， 以 甲醇 为溶剂， 生成 2-Methyl-acrylic acid 3-[4-((E)-2-{4-[bis-(2-hydroxy-ethyl)-sulfamoyl]-phenyl}-vinyl)-phenoxy]-propyl ester
  参考文献：
  名称：

  通过原位光聚合产生二次谐波的新型聚合物的同时稳定和成像

  摘要：

  从异佛尔酮二异氰酸酯和磺酰胺 CH 2 =C(Me)COO(CH 2 ) 3 OPhCH=CHPhSO 2 N([CH 2 ] 2 OH) 2 获得的聚氨酯的光化学交联用于稳定各向异性排列发色团，同时对聚合物进行光成像以直接制造器件。在 150°C 下极化的交联薄膜的长期稳定性研究表明，非线性光学响应保持高（r 33 = 0.5 pm/V，在 633 nm 处，在 2.1 μm 厚的薄膜上，在 50 V 下极化）并且基本上不受影响在 100°C 下经过数周

  DOI：

  10.1021/ja00078a091
• 作为产物：
  描述：

  4-乙酰氧基苯乙烯 、 二碳酸二叔丁酯 在 四甲基氢氧化铵 作用下， 以54 %的产率得到叔丁基4-乙烯基苯基碳酸酯
  参考文献：
  名称：

  烯烃的铜 (I) 光催化溴硝基烷基化：高效内球通路的证据

  摘要：

  在 Cu I -光催化剂存在下，具有广泛范围的活化和未活化烯烃的光催化溴硝基烷基化成为可能。这种转化成功的关键是 Cu II与自由基中间体的高效相互作用，它甚至可以胜过从瞬态自由基到持久自由基的高度有利的环化。

  DOI：

  10.1002/anie.202219086

文献信息

• PHOTOSENSITIVE RESIN COMPOSITION, OXIME SULFONATE COMPOUND, METHOD FOR FORMING CURED FILM, CURED FILM, ORGANIC EL DISPLAY DEVICE, AND LIQUID CRYSTAL DISPLAY DEVICE
  申请人：FUJIFILM Corporation

  公开号：US20130171415A1

  公开（公告）日：2013-07-04

  Disclosed is a photosensitive resin composition comprising: (Component A) an oxime sulfonate compound represented by Formula (1); (Component B) a resin comprising a constituent unit having an acid-decomposable group that is decomposed by an acid to form a carboxyl group or a phenolic hydroxy group; and (Component C) a solvent wherein in Formula (1) R 1 denotes an alkyl group, an aryl group, or a heteroaryl group, each R 2 independently denotes a hydrogen atom, an alkyl group, an aryl group, or a halogen atom, Ar 1 denotes an o-arylene group or an o-heteroarylene group, X denotes O or S, and n denotes 1 or 2, provided that of two or more R 2 s present in the compound, at least one denotes an alkyl group, an aryl group, or a halogen atom.

  揭示了一种光敏树脂组合物，包括：（组分A）由式（1）表示的肟磺酸盐化合物；（组分B）包括具有可被酸分解的基团的树脂，该基团通过酸分解形成羧基或酚羟基；和（组分C）溶剂 其中在式（1）中，R1表示烷基、芳基或杂芳基，每个R2独立地表示氢原子、烷基、芳基或卤素原子，Ar1表示邻芳撑基或邻杂芳撑基，X表示O或S，n表示1或2，前提是在化合物中存在两个或两个以上的R2时，至少有一个表示烷基、芳基或卤素原子。
• Lewis Base Catalyzed Dioxygenation of Olefins with Hypervalent Iodine Reagents
  作者：Liangkun Pan、Zhihai Ke、Ying-Yeung Yeung

  DOI：10.1021/acs.orglett.1c02872

  日期：2021.11.5

  2-Diols are extremely useful building blocks in organic synthesis. Hypervalent iodine reagents are useful for the vicinal dihydroxylation of olefins to give 1,2-diols under metal-free conditions, but strongly acidic promoters are often required. Herein, we report a catalytic vicinal dioxygenation of olefins with hypervalent iodine reagents using Lewis bases as catalysts. The conditions are mild and compatible

  1,2-二醇是有机合成中极其有用的组成部分。高价碘试剂可用于在无金属条件下将烯烃邻位二羟基化生成 1,2-二醇，但通常需要强酸性促进剂。在此，我们报告了使用路易斯碱作为催化剂，烯烃与高价碘试剂的催化邻位双氧化反应。条件温和，可与各种官能团相容。
• Cu-based carbene involved in a radical process: a new crossover reaction to construct γ-peroxy esters and 1,4-dicarbonyl compounds
  作者：Jiewen Jiang、Jiajun Liu、Ling Yang、Ying Shao、Jiang Cheng、Xiaoguang Bao、Xiaobing Wan

  DOI：10.1039/c5cc05183e

  日期：——

  Herein, a novel crossover reaction of Cu-based carbene, olefin, and tert-butyl hydroperoxide (TBHP) was well developed, leading to γ-peroxy esters and 1,4-dicarbonyl compounds.

  这里，发展了一种新颖的Cu基卡宾、烯烃和叔丁基过氧化氢（TBHP）的交叉反应，产生了γ-过氧酯和1,4-二羰化合物。
• [EN] MODIFIED THIOXANTHONE PHOTOINITIATORS<br/>[FR] PHOTO-INITIATEURS À THIOXANTHONE MODIFIÉS
  申请人：LINTFIELD LTD

  公开号：WO2021144582A1

  公开（公告）日：2021-07-22

  Latent photoinitiator compounds are described, as well as compositions containing such compounds and their uses in photoinitated methods for producing photoresist structured.

  潜在的光引发剂化合物被描述，以及含有这种化合物的组合物，以及它们在生产光阻结构的光引发方法中的用途。
• BORATE-BASED BASE GENERATOR, AND BASE-REACTIVE COMPOSITION COMPRISING SUCH BASE GENERATOR
  申请人：WAKO PURE CHEMICAL INDUSTRIES, LTD.

  公开号：US20160340374A1

  公开（公告）日：2016-11-24

  An object of the present invention is to provide a compound which is capable of attaining a composition having high storage stability without reacting with a base-reactive compound, even in the case of storage for a long period of time in a mixed state with the base-reactive compound, such as an epoxy-based compound, as well as capable of generating a strong base (guanidines, biguanides, phosphazenes or phosphoniums) by irradiation of light (active energy rays) or heating; a base generator comprising the compound; and a base-reactive composition comprising the base generator and the base-reactive compound. The present invention relates to the compound represented by the general formula (A); the base generator comprising the compound; and the base-reactive composition comprising the base generator and the base-reactive compound. (wherein R 1 represents an alkyl group; an arylalkynyl group which may be substituted with a halogen atom, an alkyl group, an alkoxy group, or an alkylthio group; an alkenyl group; a 2-furylethynyl group; a 2-thiophenylethynyl group; or a 2,6-dithianyl group; R 2 to R 4 each independently represent an alkyl group; an arylalkynyl group which may be substituted with a halogen atom, an alkyl group, an alkoxy group, or an alkylthio group; the aryl group which may be substituted with a halogen atom, an alkyl group, an alkoxy group, or an alkylthio group; a furanyl group; a thienyl group; or an N-alkyl-substituted pyrrolyl group; Z + represents an ammonium cation having a guanidinium group, a biguanidium group or a phosphazenium group, or a phosphonium cation.)

  本发明的目的是提供一种化合物，能够在与碱反应性化合物混合状态长时间存储的情况下，仍能获得具有高储存稳定性的组合物，而不与碱反应性化合物发生反应，同时还能通过光照（活性能量射线）或加热产生强碱（胍胺、双胍胺、磷氮烷或磷銨）；包括该化合物的碱发生器；以及包括该碱发生器和碱反应性化合物的碱反应性组合物。本发明涉及由通式（A）表示的化合物；包括该化合物的碱发生器；以及包括该碱发生器和碱反应性化合物的碱反应性组合物。（其中R1代表烷基；可能被卤素原子、烷基、烷氧基或烷硫基取代的芳基炔基；烯基；2-呋喃基炔基；2-噻吩基炔基；或2,6-二硫基基；R2到R4各自独立地代表烷基；可能被卤素原子、烷基、烷氧基或烷硫基取代的芳基炔基；可能被卤素原子、烷基、烷氧基或烷硫基取代的芳基；呋喃基；噻吩基；或N-烷基取代的吡咯基；Z+代表具有胍胺基团、双胍胺基团或磷氮烷基团的铵阳离子，或磷銨阳离子。）