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1-氧代-1-苯并噻吩-3-酮 | 53894-49-8

中文名称
1-氧代-1-苯并噻吩-3-酮
中文别名
——
英文名称
benzothiophen-3(2H)-one 1-oxide
英文别名
benzo[b]thiophen-3(2H)-one 1-oxide;Benzothiophen-3(2H)-on-1-oxid;1H-1-Benzothiophene-1,3(2H)-dione;1-oxo-1-benzothiophen-3-one
1-氧代-1-苯并噻吩-3-酮化学式
CAS
53894-49-8
化学式
C8H6O2S
mdl
——
分子量
166.2
InChiKey
LFOCNSKWRFQKPQ-UHFFFAOYSA-N
BEILSTEIN
——
EINECS
——
  • 物化性质
  • 计算性质
  • ADMET
  • 安全信息
  • SDS
  • 制备方法与用途
  • 上下游信息
  • 反应信息
  • 文献信息
  • 表征谱图
  • 同类化合物
  • 相关功能分类
  • 相关结构分类

计算性质

  • 辛醇/水分配系数(LogP):
    0.7
  • 重原子数:
    11
  • 可旋转键数:
    0
  • 环数:
    2.0
  • sp3杂化的碳原子比例:
    0.12
  • 拓扑面积:
    53.4
  • 氢给体数:
    0
  • 氢受体数:
    3

上下游信息

  • 上游原料
    中文名称 英文名称 CAS号 化学式 分子量

反应信息

  • 作为反应物:
    描述:
    1-氧代-1-苯并噻吩-3-酮sodium methylate 作用下, 以 四氢呋喃甲醇 为溶剂, 反应 0.17h, 生成
    参考文献:
    名称:
    Tamura, Yasumitsu; Uenishi, Jun-ichi; Ishibashi, Hiroyuki, Chemical and pharmaceutical bulletin, 1984, vol. 32, # 3, p. 898 - 901
    摘要:
    DOI:
  • 作为产物:
    描述:
    1-苯并噻吩-3(2H)-酮 在 sodium perborate tetrahydrate 、 溶剂黄146乙酸乙酯 作用下, 反应 1.5h, 以0.4 g的产率得到1-氧代-1-苯并噻吩-3-酮
    参考文献:
    名称:
    氧化半硫靛蓝光电开关-氧化态对(光)物理和光化学性质的影响。
    摘要:
    仔细研究半硫靛蓝光开关的亚砜和砜衍生物的光物理和光化学性质,并将其与未氧化的母发色团进行比较。氧化会导致吸收发生明显的蓝移,并且大部分降低光致变色现象,而单个异构体的热稳定性在很大程度上保持不变。与母体半硫靛蓝相比,有效的光转换发生在较短的波长上,并且在各个光平稳状态下可逆地获得高异构体产率。对于扭曲的砜衍生物,观察到可逆的固态光开关,并伴有可见的颜色变化。这些结果将氧化的半硫靛蓝光电开关确立为在广泛的应用中对分子行为进行稳健的光控制的有前途和多功能的工具。
    DOI:
    10.1002/chem.202002176
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文献信息

  • [EN] OXABOROLE ESTERS AND USES THEREOF<br/>[FR] ESTERS D'OXABOROLE ET LEURS UTILISATIONS
    申请人:ANACOR PHARMACEUTICALS INC
    公开号:WO2017195069A1
    公开(公告)日:2017-11-16
    The present invention provides oxaborole ester compounds and compositions thereof which are useful to treat diseases associated with parasites, such as Chagas Disease and African Animal Trypanosomosis.
    本发明提供了氧硼酯酯化合物及其组合物,可用于治疗与寄生虫相关的疾病,如充血性心脏病和非洲动物锥虫病。
  • COMPOSITION, CURED FILM, NEAR INFRARED RAY ABSORPTION FILTER, SOLID-STATE IMAGING DEVICE, INFRARED SENSOR, AND COMPOUND
    申请人:FUJIFILM Corporation
    公开号:US20170137444A1
    公开(公告)日:2017-05-18
    It is possible to provide a composition that has absorption in a near infrared region and that can form a film having transparency in a visible region. Provided are a cured film, a near infrared ray absorption filter, a solid-state imaging device, an infrared sensor, and a compound. Provided is a composition including: a near infrared ray absorption substance of which a maximum absorption wavelength is in a wavelength range of 700 to 1,000 nm and a value obtained by dividing absorbance at a wavelength of 550 nm by absorbance at the maximum absorption wavelength is 0.015 or less. In the near infrared ray absorption substance, a half-width of the maximum absorption wavelength is preferably 60 nm or less. The near infrared ray absorption substance is preferably a compound having a pyrrolopyrrole skeleton and more preferably a pyrrolopyrrole boron compound.
    可以提供一种在近红外区域具有吸收并且可以形成具有可见区域透明度的薄膜的组合物。提供了一种固化膜、近红外线吸收滤光片、固态成像装置、红外线传感器和化合物。提供的组合物包括:一种近红外线吸收物质,其最大吸收波长位于700至1,000 nm的波长范围内,且在550 nm波长处的吸光度除以最大吸收波长处的吸光度的值为0.015或以下。在近红外线吸收物质中,最大吸收波长的半峰宽最好为60 nm或以下。近红外线吸收物质最好是具有吡咯吡咯骨架的化合物,更好的是吡咯吡咯硼化合物。
  • Luminescent device material, luminescent device using the same, and amine compound
    申请人:Nii Kazumi
    公开号:US20050065351A1
    公开(公告)日:2005-03-24
    A styrylamine compound comprising a structure represented by the following formula (XI): wherein Z 2 , R 21 , R 22 , R 26 , R 27 and n are as defined in the specification.
    一种含有以下式子(XI)所代表结构的苯基胺化合物:其中Z2,R21,R22,R26,R27和n的定义如规范中所述。
  • Photoelectric conversion material, film containing the material, photoelectric conversion device, production method thereof, photosensor, imaging device and their use methods
    申请人:Fujifilm Corporation
    公开号:EP2292586A2
    公开(公告)日:2011-03-09
    A compound represented by the following formula (I), and a photoelectric conversion device containing the compound: wherein Z1 is a ring containing two carbon atoms and represents a 5-membered ring, a 6-membered ring or a condensed ring containing at least either a 5-membered ring or a 6-membered ring, each of L1, L2 and L3 independently represents an unsubstituted methane group or a substituted methine group, n represents an integer of 0 or more, each of R1, R2, R3, R4, R5 and R6 independently represents a hydrogen atom or a substituent, R1 and R2, R2 and R3, R4 and R5, or R5 and R6 may be combined with each other to form a ring, and each of R21 and R22 independently represents a substituted aryl group, an unsubstituted aryl group, a substituted heteroaryl group or an unsubstituted heteroaryl group, provided that the case where both R21 and R22 are an unsubstituted phenyl group is excluded.
    下式 (I) 所代表的化合物,以及含有该化合物的光电转换装置: 其中 Z1 是含有两个碳原子的环,代表 5 元环、6 元环或至少含有一个 5 元环或一个 6 元环的缩合环,L1、L2 和 L3 各自独立地代表未取代的甲烷基团或取代的甲基,n 代表 0 或以上的整数,R1、R2、R3、R4、R5 和 R6 各自独立地代表氢原子或取代基、R1和R2、R2和R3、R4和R5或R5和R6可相互结合形成一个环,R21和R22各自独立地代表取代的芳基、未取代的芳基、取代的杂芳基或未取代的杂芳基,但不包括R21和R22均为未取代的苯基的情况。
  • Compounds for use in a photoelectric conversion material, and intermediates for the preparation thereof
    申请人:Fujifilm Corporation
    公开号:EP2786983A1
    公开(公告)日:2014-10-08
    The invention provides a compound represented by the following formula (V): Also claimed are compounds of formula (I) which are useful as a photoelectric conversion material. The aldehydes of formula (V) are intermediates in the preparation of compounds of formula (I).
    本发明提供了由下式(V)代表的化合物: 本发明还涉及可用作光电转换材料的式 (I) 化合物。式(V)的醛是制备式(I)化合物的中间体。
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