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2-(4,5-di-(2-cyanoethylthio)-1,3-dithiol-2-ylidene)-4,5-di-(2-cyanoethylthio)-1,3-dithiole | 84356-34-3

中文名称
——
中文别名
——
英文名称
2-(4,5-di-(2-cyanoethylthio)-1,3-dithiol-2-ylidene)-4,5-di-(2-cyanoethylthio)-1,3-dithiole
英文别名
2-[4,5-Bis(sulfanyl)-1,3-dithiol-2-ylidene]-1,3-dithiole-4,5-dithiol
2-(4,5-di-(2-cyanoethylthio)-1,3-dithiol-2-ylidene)-4,5-di-(2-cyanoethylthio)-1,3-dithiole化学式
CAS
84356-34-3
化学式
C6H4S8
mdl
——
分子量
332.626
InChiKey
BXAHRSQOIGUFJO-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):
    4
  • 重原子数:
    14
  • 可旋转键数:
    0
  • 环数:
    2.0
  • sp3杂化的碳原子比例:
    0.0
  • 拓扑面积:
    105
  • 氢给体数:
    4
  • 氢受体数:
    8

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:
    2-(4,5-di-(2-cyanoethylthio)-1,3-dithiol-2-ylidene)-4,5-di-(2-cyanoethylthio)-1,3-dithiole3-氯丙基三乙氧基硅烷N,N-二甲基甲酰胺 为溶剂, 反应 1.0h, 以0.88 g的产率得到3-[[2-[4,5-Bis(3-triethoxysilylpropylsulfanyl)-1,3-dithiol-2-ylidene]-5-(3-triethoxysilylpropylsulfanyl)-1,3-dithiol-4-yl]sulfanyl]propyl-triethoxysilane
    参考文献:
    名称:
    Auto-organization modulation of tetrasubstituted tetrathiafulvalenes (TTF) in silica based hybrid materials
    摘要:
    The effect of the interactions generated by the spacer group between the TTF core and the four triethoxysilane groups on the auto-organization of the organic bridging moieties in hybrid materials obtained by sol-gel chemistry has been investigated. The silica-based hybrid solids are highly polycondensed. They present different scales of organization (nanometric and micrometric) that are independent one from each other and are governed by the different parameters which control the kinetics of polycondensation. Their anisotropic organization is function of the interaction forces induced by the spacer, van der Waals, hydrogen bonding or both, during the hydrolytic condensation process. (c) 2006 Elsevier B.V. All rights reserved.
    DOI:
    10.1016/j.jorganchem.2006.09.034
  • 作为产物:
    参考文献:
    名称:
    双(环戊二烯基)二硫代钼四硫富瓦烯络合物中有机-有机金属电泳之间的相互作用
    摘要:
    已知四硫富瓦烯(TTF)和双(环戊二烯基)二硫代钼钼配合物Cp 2 Mo(二硫代烯)配合物可作为良好的电子供体分子。为了研究两种电泳之间的相互作用,合成并表征了两种类型的复合物。第一种具有一个与一个TTF二硫代盐配体配位的Cp 2 Mo片段,第二种具有一个桥接两个Cp 2的TTF双(二硫代盐)莫碎片。这些配合物的电化学性质与每种单独的电泳模型的电化学性质的比较提供了它们相互影响的证据。所有这些络合物都具有很好的电子供体的作用,其第一氧化电位比四(甲硫基)TTF低430 mV。DFT计算表明,中性复合物的HOMO和阳离子的SOMO在整个TTF二硫代酸酯配体上是离域的。X射线晶体结构分析的中性和单氧化的Cp 2 Mo(dithiolene)(bismethylthio)TTF配合物与最高占据的前沿分子轨道的离域分配是一致的。紫外可见近红外光谱电化学研究证实了TTF二硫酸酯配体中的这种电子离域。
    DOI:
    10.1021/acs.inorgchem.5b00632
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文献信息

  • [EN] SULFUR-CONTAINING INORGANIC-ORGANIC HYBRID MATERIALS AND METHODS FOR MAKING THE SAME<br/>[FR] MATÉRIAUX HYBRIDES INORGANIQUES-ORGANIQUES CONTENANT DU SOUFRE ET LEURS PROCÉDÉS DE FABRICATION
    申请人:UNIV CHICAGO
    公开号:WO2021081172A1
    公开(公告)日:2021-04-29
    Coordination complexes of tetrathiafulvalene-based dithiolene linkers, such as tetrathiafulvalene-2,3,6,7-tetrathiolate (TTFtt), and their oxidation products are described. The coordination complexes can include metals such as tin or silicon. Also described are methods of using the coordination complexes in transmetallation reactions, e.g., to prepare sulfur coordination polymers, and sulfur coordination polymers doped with tetrathiafulvalene-based dithiolene linkers having different oxidation states.
    描述了基于四硫富瓦烯二硫辛联结物的配位配合物,例如四硫富瓦烯-2,3,6,7-四硫酸盐(TTFtt)及其氧化产物。这些配位配合物可以包括金属,如锡或硅。还描述了利用这些配位配合物进行金属交换反应的方法,例如用于制备硫配位聚合物,以及掺杂有具有不同氧化态的基于四硫富瓦烯二硫辛联结物的硫配位聚合物。
  • Isolation and characterisation of a new monodithiolate gold(III) complex
    作者:Masaki Takahashi、Neil Robertson、Robin J.H. Clark、Allan E. Underhill
    DOI:10.1016/s0277-5387(98)00437-9
    日期:1999.4
    A monodithiolate gold complex (1), potassium[dichloro(1,3,5-trithiepin-6,7-dithiolato)aurate] was isolated in a 1:1 reaction of 1,3,5-trithiepin-6,7-dithiolato (ttdt) and potassium tetrachloroaurate. 1 was characterised by its elemental analysis, IR and Raman spectra.
    在1,3,5-三噻吩-6,7-二硫代拉托醇的1:1反应中分离出单二硫醇盐金络合物(1)[二氯(1,3,5-trithiepin-6,7-二硫代拉托氨基)钾盐] (ttdt)和四氯金酸钾。图1通过其元素分析,IR和拉曼光谱表征。
  • CURABLE FLUORINATED RESIN COMPOSITION
    申请人:Asahi Glass Company, Limited
    公开号:EP2532709A1
    公开(公告)日:2012-12-12
    To provide a fluorinated curable resin composition which is excellent in thermal stability and thermal adhesive property. A fluorinated curable resin composition comprising a fluoropolymer (P) having a polymerizable double bond and a thiol compound (S), wherein the fluoropolymer (P) is a copolymer having repeating units derived from a fluoromonoene (a) and a fluorodiene (b) having a residual unsaturated side chain, and the content of the thiol compound (S) is from 0.01 to 1 part by mass per 100 parts by mass of the fluoropolymer (P).
    提供一种热稳定性和热粘合性优异的含氟固化树脂组合物。 一种含氟可固化树脂组合物,由具有可聚合双键的含氟聚合物 (P) 和硫醇化合物 (S) 组成,其中含氟聚合物 (P) 是一种共聚物,其重复单元来自具有残余不饱和侧链的氟单烯 (a) 和氟二烯 (b),硫醇化合物 (S) 的含量为每 100 份含氟聚合物 (P) 0.01 至 1 份。
  • FLUORINATED CURABLE RESIN COMPOSITION
    申请人:SUGIYAMA Norihide
    公开号:US20120292661A1
    公开(公告)日:2012-11-22
    To provide a fluorinated curable resin composition which is excellent in thermal stability and thermal adhesive property. A fluorinated curable resin composition comprising a fluoropolymer (P) having a polymerizable double bond and a thiol compound (S), wherein the fluoropolymer (P) is a copolymer having repeating units derived from a fluoromonoene (a) and a fluorodiene (b) having a residual unsaturated side chain, and the content of the thiol compound (S) is from 0.01 to 1 part by mass per 100 parts by mass of the fluoropolymer (P).
  • SULFUR-CONTAINING INORGANIC-ORGANIC HYBRID MATERIALS AND METHODS FOR MAKING THE SAME
    申请人:The University of Chicago
    公开号:US20220411445A1
    公开(公告)日:2022-12-29
    Coordination complexes of tetrathiafulvalene-based dithiolene linkers, such as tetrathiafulvalene-2,3,6,7-tetrathiolate (TTFtt), and their oxidation products are described. The coordination complexes can include metals such as tin or silicon. Also described are methods of using the coordination complexes in transmetallation reactions, e.g., to prepare sulfur coordination polymers, and sulfur coordination polymers doped with tetrathiafulvalene-based dithiolene linkers having different oxidation states.
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同类化合物

四硫杂富瓦烯-D4 四硫富瓦烯 四(戊硫代)四硫富瓦烯 四(十八烷基硫代)四硫富瓦烯 四(乙硫基)四硫富瓦烯[有机电子材料] 双(亚乙基二硫醇)四硫代富瓦烯 双(三亚甲基二硫代)四硫富瓦烯 [1,3]二噻唑并[4,5-d]-1,3-二噻唑,2,5-二(1,3-二硫醇-2-亚基)- 5-甲基二硫杂环戊烯-3-硫酮 5-氨基-3-硫代氧基-3H-(1,2)二硫杂环戊烯-4-羧酸乙酯 5-氨基-3-硫代氧基-3H-(1,2)二硫杂环戊烯-4-甲腈 5,6-二氢-4H-环戊并[1,2]二硫代-3-硫酮 4,4’,5-三甲基四硫富瓦烯 4-甲基二硫杂环戊烯-3-硫酮 4-新戊基-3H-1,2-二硫杂环戊烯-3-硫酮 4,5-二甲基-3H-1,2-二硫醇-3-酮 4,5,6,7-四氢苯并[1,2]二硫-3-硫酮 4,4’-二甲基连四硫富瓦烯 4,4,5,5,6,6,7,7-八氢二苯并四硫富瓦烯 3H-1,2-二硫杂环戊二烯-3-酮 3H-1,2-二硫杂环戊二烯-3-硫酮 2-(4,5-二甲基-1,3-二硫杂环戊烯-2-亚基)-4,5-二甲基-1,3-二硫杂环戊烯 2,3,6,7-四(2-氰乙基硫代)四硫富瓦烯 1,3-二噻唑,2-[4,5-二(癸基硫代)-1,3-二硫醇-2-亚基]-4,5-二(癸基硫代)- (四甲基硫)四硫富瓦烯 2,3,6,7-tetrakis[2-(2-methoxyethoxy)ethylsulfanyl]tetrathiafulvalene 2,3-bis[2-(2-methoxyethoxy)ethylsulfanyl]-6,7-bis(methylsulfanyl)tetrathiafulvalene (5S,6S,5'S,6'S)-5,5',6,6'-tetramethyl-bis(ethylenedithio)tetrathiafulvalene 2,5-bis(4,5-ethylenedithio-1,3-dithiol-2-ylidene)-1,3,4,6-tetrathiapentalene 2,3,6,7-Tetrakis(1-octyloxymethyl)tetrathiafulvalene 2,3,6,7-Tetrakis(1-dodecyloxymethyl)tetrathiafulvalene 2,3,6,7-Tetrakis(1-pentyloxymethyl)tetrathiafulvalene 2,3,6,7-Tetrakis(1-hexyloxymethyl)tetrathiafulvalene 2,3,6,7-Tetrakis(1-propoxymethyl)tetrathiafulvalene 2,3,6,7-Tetrakis(1-decyloxymethyl)tetrathiafulvalene 2,3,6,7-Tetrakis(1-heptyloxymethyl)tetrathiafulvalene 2,6-bis(thioacetopentadecylamido)-3,7-bis(methylthiotetrathiafulvalene) 2,7-bis(thioacetopentadecylamido)-3,6-bis(methylthiotetrathiafulvalene) ethane 1,2-dithiol 2,3,6,7-Tetrakis(1-tetradecyloxymethyl)tetrathiafulvalene 2-Isopropyliden-1,3-dithiol-4,5-dicarbonitril 4,5-bis(butylthio)tetrathiafulvalene 2,3-dicyano-6,7-bis(butylthio)tetrathiafulvalene Tetrabutylammonium-(3-thioxo-3H-1,2-dithiol-5-thiolat) 5,6-dihydro-5-dimethoxymethyl-2-(5',6'-dihydro-1,3-dithiolo[4,5-b]-1,4-dithiin-2'-ylidene)-1,3-dithiolo[4,5-b]-1,4-dithiin 3H-1,2-dithiole 2,2'-(But-2-en-1,4-diyliden)bis[1,3-dithiol-4,5-dicarbonitril] 3-methylsulfanyl-[1,2]dithiolylium; iodide 2,2'-(Dodeca-2,4,6,8,10-pentaen-1,12-diyliden)bis[1,3-dithiol-4,5-dicarbonitril] (E,E)-1,6-bis[4,5-bis(methylsulfanyl)-1,3-dithiol-2-ylidene]hexa-2,4-diene