[1,1'-联苯基]-3,4'-二醇 | 18855-13-5

• 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: [1,1'-联苯基]-3,4'-二醇
• 英文名称: Biphenyl-3,4'-diol
• 英文别名: 3,4'-dihydroxybiphenyl；1,1'-biphenyl-3,4'-diol；3,4'-biphenyldiol；(1,1'-biphenyl)-3,4'-diol；[1,1'-Biphenyl]-3,4'-diol；3-(4-hydroxyphenyl)phenol
• CAS: 18855-13-5
• 化学式: C₁₂H₁₀O₂
• 分子量: 186.21
• InChiKey: BWBGEYQWIHXDKY-UHFFFAOYSA-N

物化性质

• 熔点：
  190 °C
• 沸点：
  384.2±25.0 °C(Predicted)
• 密度：
  1.228±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  2.9
• 重原子数：
  14
• 可旋转键数：
  1
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  40.5
• 氢给体数：
  2
• 氢受体数：
  2

安全信息

• 海关编码：
  2907299090

SDS

Material Safety Data Sheet

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Section 1. Identification of the substance
Product Name: 4-(3-Hydroxyphenyl)phenol
Synonyms:

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Section 2. Hazards identification
Harmful by inhalation, in contact with skin, and if swallowed.

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Section 3. Composition/information on ingredients.
Ingredient name: 4-(3-Hydroxyphenyl)phenol
CAS number: 18855-13-5

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Section 4. First aid measures
Skin contact: Immediately wash skin with copious amounts of water for at least 15 minutes while removing
contaminated clothing and shoes. If irritation persists, seek medical attention.
Eye contact: Immediately wash skin with copious amounts of water for at least 15 minutes. Assure adequate
flushing of the eyes by separating the eyelids with fingers. If irritation persists, seek medical
attention.
Inhalation: Remove to fresh air. In severe cases or if symptoms persist, seek medical attention.
Ingestion: Wash out mouth with copious amounts of water for at least 15 minutes. Seek medical attention.

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Section 5. Fire fighting measures
In the event of a fire involving this material, alone or in combination with other materials, use dry
powder or carbon dioxide extinguishers. Protective clothing and self-contained breathing apparatus
should be worn.

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Section 6. Accidental release measures
Personal precautions: Wear suitable personal protective equipment which performs satisfactorily and meets local/state/national
standards.
Respiratory precaution: Wear approved mask/respirator
Hand precaution: Wear suitable gloves/gauntlets
Skin protection: Wear suitable protective clothing
Eye protection: Wear suitable eye protection
Methods for cleaning up: Mix with sand or similar inert absorbent material, sweep up and keep in a tightly closed container
for disposal. See section 12.
Environmental precautions: Do not allow material to enter drains or water courses.

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Section 7. Handling and storage
Handling: This product should be handled only by, or under the close supervision of, those properly qualified
in the handling and use of potentially hazardous chemicals, who should take into account the fire,
health and chemical hazard data given on this sheet.
Store in closed vessels, refrigerated.
Storage:

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Section 8. Exposure Controls / Personal protection
Engineering Controls: Use only in a chemical fume hood.
Personal protective equipment: Wear laboratory clothing, chemical-resistant gloves and safety goggles.
General hydiene measures: Wash thoroughly after handling. Wash contaminated clothing before reuse.

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Section 9. Physical and chemical properties
Appearance: Not specified
Boiling point: No data
No data
Melting point:
Flash point: No data
Density: No data
Molecular formula: C12H10O2
Molecular weight: 186.2

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Section 10. Stability and reactivity
Conditions to avoid: Heat, flames and sparks.
Materials to avoid: Oxidizing agents.
Possible hazardous combustion products: Carbon monoxide.

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Section 11. Toxicological information
No data.

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Section 12. Ecological information
No data.

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Section 13. Disposal consideration
Arrange disposal as special waste, by licensed disposal company, in consultation with local waste
disposal authority, in accordance with national and regional regulations.

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Section 14. Transportation information
Non-harzardous for air and ground transportation.

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Section 15. Regulatory information
No chemicals in this material are subject to the reporting requirements of SARA Title III, Section
302, or have known CAS numbers that exceed the threshold reporting levels established by SARA
Title III, Section 313.

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SECTION 16 - ADDITIONAL INFORMATION
N/A

反应信息

• 作为反应物：
  描述：

  [1,1'-联苯基]-3,4'-二醇 在 4-二甲氨基吡啶 、 乙醇 、 4-甲基苯磺酸吡啶 、 N,N'-二环己基碳二亚胺 作用下， 以 二氯甲烷 为溶剂， 反应 48.0h， 生成 3,4'-biphenyldiyl bis(4-hydroxybenzoate)
  参考文献：
  名称：

  通过纯活性香蕉形液晶的原位光聚合获得的 SmCP 网络化薄膜

  摘要：

  已经进行了反应性香蕉形化合物的合成和表征，并评估了它们在 SmCP 中间相中光聚合的能力。X 射线研究证实了这些化合物中存在 SmCP 液晶相。这些分子的聚合已通过量热技术以及室温下机械稳定的 SmCP 有序游离薄膜的制备和表征得到证实。此外，聚合薄膜在没有电场的情况下在室温下表现出二次谐波产生活性。

  DOI：

  10.1021/ja048437k
• 作为产物：
  描述：

  4-(3-甲氧基苯基)苯酚 在 三溴化硼 作用下， 生成 [1,1'-联苯基]-3,4'-二醇
  参考文献：
  名称：

  METHOD OF PRODUCING BIPHENOLIC COMPOUND, NOVEL BIPHENYL COMPOUND AND SYNTHESIS METHOD THEREOF, AND PHARMACEUTICAL COMPOSITION FOR TREATING PARKINSON'S DISEASE

  摘要：

  本发明公开了一种生产厚朴酚及其类似物的方法，以及由此制备的新颖中间体。还公开了一种用于治疗帕金森病的药物组合物，该组合物包含厚朴酚和/或其类似物。

  公开号：

  US20130303788A1
• 作为试剂：
  描述：

  2-(3'-methoxy-biphenyl-4-yloxy)-tetrahydro-pyran 、 对甲苯磺酸 、 三溴化硼 在 [1,1'-联苯基]-3,4'-二醇 作用下， 以Therefore, biphenyl-3,4′-diol (compound 32) as a solid was obtained (90% yield over two steps)的产率得到[1,1'-联苯基]-3,4'-二醇
  参考文献：
  名称：

  METHOD OF PRODUCING BIPHENOLIC COMPOUND, NOVEL BIPHENYL COMPOUND AND SYNTHESIS METHOD THEREOF, AND PHARMACEUTICAL COMPOSITION FOR TREATING PARKINSON'S DISEASE

  摘要：

  本文介绍了一种生产本草酚和其类似物的方法，以及由此制备的新型中间体。本文还公开了一种治疗帕金森病的药物组合物，其中包含本草酚和/或其类似物。

  公开号：

  US20130303788A1

文献信息

• Antibacterial macrocycles with substituted biphenyl
  申请人：Endermann Rainer

  公开号：US20070099885A1

  公开（公告）日：2007-05-03

  The invention relates to antibacterial macrocycles with substituted biphenyl and processes for their preparation, their use for the treatment and/or prophylaxis of diseases, and their use for the production of medicaments for the treatment and/or prophylaxis of diseases, especially of bacterial infections.

  这项发明涉及具有取代联苯基的抗菌大环化合物，以及它们的制备方法，它们用于治疗和/或预防疾病，以及它们用于生产用于治疗和/或预防疾病的药物，特别是细菌感染。
• Aromatic Amide Compound
  申请人：Nair Kamlesh P.

  公开号：US20130048911A1

  公开（公告）日：2013-02-28

  An aromatic amide compound having the following general formula (I) is provided: wherein, X 1 and X 2 are independently C(O)HN or NHC(O); G 1 , G 2 and G 3 are independently hydrogen, C(O)HN-phenyl, or NHC(O)-phenyl, wherein at least one of G 1 , G 2 and G 3 is C(O)HN-phenyl or NHC(O)-phenyl; Q 1 , Q 2 , and Q 3 are independently hydrogen, C(O)HN-phenyl, or NHC(O)-phenyl, wherein at least one of Q 1 , Q 2 , and Q 3 is C(O)HN-phenyl or NHC(O)-phenyl; R 5 is halo, haloalkyl, alkyl, alkenyl, aryl, heteroaryl, cycloalkyl, or heterocyclyl; and m is from 0 to 4.

  提供了一种具有以下通式(I)的芳香酰胺化合物：其中，X1和X2独立地为C(O)HN或NHC(O)；G1、G2和G3独立地为氢、C(O)HN-苯基或NHC(O)-苯基，其中至少一个G1、G2和G3为C(O)HN-苯基或NHC(O)-苯基；Q1、Q2和Q3独立地为氢、C(O)HN-苯基或NHC(O)-苯基，其中至少一个Q1、Q2和Q3为C(O)HN-苯基或NHC(O)-苯基；R5为卤素、卤代烷基、烷基、烯基、芳基、杂芳基、环烷基或杂环烷基；m为0至4。
• Polymerizable compound and liquid crystal composition including it
  申请人：Ito Maiko

  公开号：US08394468B2

  公开（公告）日：2013-03-12

  Provided is a polymerizable compound with large solubility in a liquid crystal composition and high reactivity irradiated by ultraviolet in the longer wavelength range. Provided is a liquid crystal composition that satisfies at least one of characteristics such as high maximum temperature of a nematic phase, low minimum temperature of a nematic phase, small viscosity, suitable optical anisotropy, large negative dielectric anisotropy, large specific resistance, high stability to ultraviolet light and high stability to heat, or that is suitably balanced between at least two of the characteristics. Provided is the polymerizable compound wherein at least one of a 1,3-phenylene structure and a 2,7-fluorenediyl structure is introduced to the polymerizable compound to give stable displays by forming a polymer with a high degree of polymerization in a PSA device production process using longer wavelengths, the liquid crystal composition includes the compound, and the liquid crystal display device contains the composition.

  提供了一种具有较大溶解度的聚合物化合物，其在液晶组合物中具有高反应性，可被紫外线在较长波长范围内辐照。提供了一种液晶组合物，满足至少以下特征之一：向列相的最高温度高，向列相的最低温度低，粘度小，适当的光学各向异性，较大的负介电各向异性，较大的特定电阻，对紫外光的高稳定性和对热的高稳定性，或在至少两种特征之间适当平衡。提供了一种聚合物化合物，其中至少引入了1,3-苯基结构和2,7-芴二基结构之一到聚合物化合物中，通过在使用较长波长的PSA设备生产过程中形成具有高聚合度的聚合物，从而提供稳定的显示，液晶组合物包括该化合物，液晶显示装置包含该组合物。
• Small Molecule NF-κB Inhibitors as Immune Potentiators for Enhancement of Vaccine Adjuvants
  作者：Brittany A. Moser、Yoseline Escalante-Buendia、Rachel C. Steinhardt、Matthew G. Rosenberger、Britteny J. Cassaidy、Nihesh Naorem、Alfred C. Chon、Minh H. Nguyen、Ngoctran T. Tran、Aaron P. Esser-Kahn

  DOI：10.3389/fimmu.2020.511513

  日期：——

  Adjuvants are added to vaccines to enhance the immune response and provide increased protection against disease. In the last decade, hundreds of synthetic immune adjuvants have been created, but many induce undesirable levels of proinflammatory cytokines including TNF-α and IL-6. Here we present small molecule NF-κB inhibitors that can be used in combination with an immune adjuvant to both decrease

  疫苗中添加佐剂可增强免疫反应并增强对疾病的保护。在过去的十年中，数百种合成免疫佐剂被创造出来，但许多都会诱导促炎细胞因子（包括 TNF-α 和 IL-6）达到不良水平。在这里，我们提出了小分子 NF-κB 抑制剂，可与免疫佐剂联合使用，以减少与耐受性差相关的标记物并改善疫苗接种的保护反应。此外，我们合成了和厚朴酚衍生物库，确定了几种有希望用于疫苗制剂的候选物。
• Aerobic Oxidative Heck/Dehydrogenation Reactions of Cyclohexenones: Efficient Access to<i>meta</i>-Substituted Phenols
  作者：Yusuke Izawa、Changwu Zheng、Shannon S. Stahl

  DOI：10.1002/anie.201209457

  日期：2013.3.25

  catalyst, employing a 6,6′‐dimethyl‐2,2′‐bipyridine ligand, promotes both the aerobic oxidative Heck coupling and dehydrogenation reactions of cyclohexenones. These reactions may be combined in a one‐pot sequence to enable the straightforward synthesis of meta‐substituted phenols (see scheme).

  争夺（间）位：一种新型双阳离子钯（II）催化剂，采用 6,6'-二甲基-2,2'-联吡啶配体，促进环己烯酮的有氧氧化 Heck 偶联和脱氢反应。这些反应可以以一锅法顺序组合，以实现间位取代酚的直接合成（参见方案）。