2-methyl-1,3-benzoxathiole | 82766-14-1

• 分子结构分类: 有机化合物 - 有机杂环化合物 - Benzoxathioles
• 英文名称: 2-methyl-1,3-benzoxathiole
• 英文别名: 2-Methyl-benz[1,3]oxathiol
• CAS: 82766-14-1
• 化学式: C₈H₈OS
• 分子量: 152.217
• InChiKey: HUKXTSJIYUFTEP-UHFFFAOYSA-N

物化性质

• 沸点：
  70-74 °C(Press: 3 Torr)
• 密度：
  1.179±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  2.7
• 重原子数：
  10
• 可旋转键数：
  0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.25
• 拓扑面积：
  34.5
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为产物：
  描述：

  2-羟基苯硫酚 、 1,1-二氯乙烷 在 sodium hydroxide 作用下， 以 乙醇 为溶剂， 反应 6.0h， 以19%的产率得到2-methyl-1,3-benzoxathiole
  参考文献：
  名称：

  Electron impact mass spectrometry of 2,2-disubstituted-1,3-benzoxathioles and spiro [1,3-benzoxathioles-2,1′-cycloalkanes]

  摘要：

  AbstractThe electron impact mass spectrometric behaviour of a series of 2,2‐disubstituted‐1,3‐benzoxathioles and spiro[1,3‐benzoxathioles‐2,1′‐cycloalkanes] has been studied in detail with the aid of linked scans and exact mass measurements. The structures of the more interesting fragment ions have been confirmed by collisional activation experiments. A precise analogy with the chemical degradative processes, obtained by the action of Grignard reagents on these compounds, is emphasized.

  DOI：

  10.1002/oms.1210170502

文献信息

• 309. Benz-1 : 3-oxathioles, benz-1 : 4-oxathien, and αω-bisarylthioalkanes
  作者：Douglas Greenwood、Herbert A. Stevenson

  DOI：10.1039/jr9530001514

  日期：——
• POLYMERIZABLE COMPOSITION AND OPTICALLY ANISOTROPIC BODY USING SAME
  申请人：DIC Corporation

  公开号：US20180002460A1

  公开（公告）日：2018-01-04

  The polymerizable composition contains: a) a polymerizable compound having one or two or more polymerizable groups and satisfying formula (I): Re(450 nm)/Re(550 nm)<1.0  (I); b) at least one photopolymerization initiator selected from the group consisting of alkylphenone-based compounds, acylphosphine oxide-based compounds, and oxime ester-based compounds; and c) a polymerization inhibitor. The present invention also provides an optically anisotropic body, a retardation film, an antireflective film, and a liquid crystal display device that are produced using the polymerizable liquid crystal composition. The polymerizable composition of the present invention is excellent in solubility and has high storage stability, so that no precipitation of crystals etc. occurs. When a film-shaped polymer is produced by polymerizing the above composition, the unevenness of the surface of the coating film is small while the alignment of the liquid crystal is maintained, and high durability is obtained. Therefore, the polymerizable composition is useful.
• Electron impact mass spectrometry of 2,2-disubstituted-1,3-benzoxathioles and spiro [1,3-benzoxathioles-2,1′-cycloalkanes]
  作者：Pietro Traldi、Umberto Vettori、Antonio Maccioni、Gianni Podda

  DOI：10.1002/oms.1210170502

  日期：1982.5

  AbstractThe electron impact mass spectrometric behaviour of a series of 2,2‐disubstituted‐1,3‐benzoxathioles and spiro[1,3‐benzoxathioles‐2,1′‐cycloalkanes] has been studied in detail with the aid of linked scans and exact mass measurements. The structures of the more interesting fragment ions have been confirmed by collisional activation experiments. A precise analogy with the chemical degradative processes, obtained by the action of Grignard reagents on these compounds, is emphasized.