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phenyl disulphide | 31819-07-5

中文名称
——
中文别名
——
英文名称
phenyl disulphide
英文别名
Phenyldisulfan;Phenylhydrodisulfid;phenyl-disulfane;phenyl disulfide;Phenyl hydrodisulfide;disulfanylbenzene
phenyl disulphide化学式
CAS
31819-07-5
化学式
C6H6S2
mdl
——
分子量
142.246
InChiKey
LAWVKJXSUUKJTK-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):
    2.5
  • 重原子数:
    8
  • 可旋转键数:
    1
  • 环数:
    1.0
  • sp3杂化的碳原子比例:
    0.0
  • 拓扑面积:
    26.3
  • 氢给体数:
    1
  • 氢受体数:
    2

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
  • 下游产品
    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:
    phenyl disulphide 作用下, 以 四氢呋喃 为溶剂, 反应 0.18h, 生成 (dodec-1-yl-trisulfanyl)benzene
    参考文献:
    名称:
    Unsymmetrical Organotrisulfide Formation via Low-Temperature Disulfanyl Anion Transfer to an Organothiosulfonate
    摘要:
    New methodology is presented for the formation of unsymmetrical organotrisulfides in a high yield and purity, relatively free of polysulfide byproducts. The highlight of the method is the low-temperature (-78 degrees C) deprotection of a disulfanyl acetate with sodium methoxide in THF to form a disulfanyl anion, which reacts rapidly in situ with an organothiosulfonate (S-aryl or S-alkyl) within 30 seconds followed by quenching. The discovery of these new reaction conditions together with the relative greenness of the chemistry overall makes for an efficient protocol, from which a range of organotrisulfides covering aliphatic, aromatic, as well as cysteine and sugar groups can be accessed in a high yield and purity.
    DOI:
    10.1021/acs.joc.8b03262
  • 作为产物:
    描述:
    苯硫酚 作用下, 生成 phenyl disulphide
    参考文献:
    名称:
    The Role of Disulfide Linkages in Desulfurization Chemistry: The Reactions of Benzenethiol on a Sulfur-Covered Mo(110) Surface
    摘要:
    The reactions of benzenethiol on a sulfur-covered Mo(110) surface were studied using temperature programmed reaction, X-ray photoelectron, and high resolution electron energy loss spectroscopies. The sulfur overlayer profoundly alters the kinetics and selectivity for desulfurization and dehydrogenation. By using isotopic labeling, we have established that phenyl disulfide (C6H5S-S-) is formed via S-H bond scission and S-S bond formation on Mo(110) at 100 K. The S-S- linkage is oriented perpendicular and the phenyl ring parallel to the surface. The disulfide subsequently forms an upright phenyl thiolate species, bound directly to the Mo(110) surface, prior to the onset of benzene formation at 300 K. In contrast to the clean surface, where only the low-temperature state is observed, a second benzene peak is observed at 500 K on the sulfur-covered surface. This feature is attributed to disproportionation of surface phenyl groups to produce gaseous benzene and surface benzyne. In addition, gaseous phenyl also desorbs from the surface in the same temperature range, due to a lack of available surface hydrogen. The selectivity for gaseous hydrocarbon production is approximately 80%, nearly twice that on the clean surface, while the total amount of reaction remains the same. These effects are attributed to (i) the initial phenyl disulfide formation, which anchors the reactant to the crowded surface, while preventing low-temperature decomposition, and (ii) stabilization of higher temperature intermediates, such as phenyl thiolate, surface phenyl, and benzyne (all of which possess a predominantly perpendicular ring orientation), by site-blocking by the sulfur overlayer.
    DOI:
    10.1021/ja00097a046
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文献信息

  • Amino-substituted heterocycles, compositions thereof, and methods of treatment therewith
    申请人:D'Sidocky Neil R.
    公开号:US20080242694A1
    公开(公告)日:2008-10-02
    Provided herein are Heterocyclic Compounds having the following structure: wherein R 1 , R 2 , X, Y and Z are as defined herein, compositions comprising an effective amount of a Heterocyclic Compound and methods for treating or preventing cancer, inflammatory conditions, immunological conditions, metabolic conditions and conditions treatable or preventable by inhibition of a kinase pathway comprising administering an effective amount of a Heterocyclic Compound to a patient in need thereof.
    本文提供具有以下结构的杂环化合物: 其中R1、R2、X、Y和Z如本文所定义,包含有效量杂环化合物的组合物,以及治疗或预防癌症、炎症性疾病、免疫疾病、代谢性疾病以及通过给予患者需要的有效量杂环化合物来抑制激酶途径治疗或预防的疾病的方法。
  • [EN] 3-'4-HETEROCYCLYL -1,2,3,-TRIAZOL-1-YL!-N-ARYL-BENZAMIDES AS INHIBITORS OF THE CYTOKINES PRODUCTION FOR THE TREATMENT OF CHRONIC INFLAMMATORY DISEASES<br/>[FR] 3-'4-HETEROCYCLYL -1,2,3,-TRIAZOL-1-YL-N-ARYL-BENZAMIDES EN TANT QU'INHIBITEURS DE LA PRODUCTION DE CYTOKINES POUR LE TRAITEMENT DE MALADIES INFLAMMATOIRES
    申请人:BOEHRINGER INGELHEIM PHARMA
    公开号:WO2005090333A1
    公开(公告)日:2005-09-29
    Disclosed compounds of formula (I), which inhibit production of cytokines involved in inflammatory processes and are thus useful for treating diseases and pathological conditions involving inflammation such as chronic inflammatory disease. Also disclosed are processes for preparing these compounds and pharmaceutical compositions comprising these compounds.
    公开的化合物式(I),可以抑制与炎症过程有关的细胞因子的产生,因此可用于治疗涉及炎症的疾病和病理状况,如慢性炎症性疾病。还公开了制备这些化合物的方法以及包含这些化合物的药物组合物。
  • Cannabinoid receptor ligands
    申请人:Schering Corporation
    公开号:US20030232859A1
    公开(公告)日:2003-12-18
    The invention relates to compounds of the formula 1 a prodrug thereof, or a pharmaceutically acceptable salt, solvate or stereoisomer of the compound or of said prodrug; which exhibit anti-inflammatory and immunodulatory activity. Also disclosed are pharmaceutical compositions containing said compounds and methods of using the compounds for the treatment of various diseases and conditions.
    这项发明涉及以下化合物的公式 1 其前药,或该化合物或前药的药用可接受的盐、溶剂合物或立体异构体;这些化合物表现出抗炎和免疫调节活性。还公开了含有这些化合物的药物组合物以及使用这些化合物治疗各种疾病和病况的方法。
  • Method and compositions for identifying anti-HIV therapeutic compounds
    申请人:GILEAD SCIENCES, INC.
    公开号:US20040121316A1
    公开(公告)日:2004-06-24
    Methods are provided for identifying anti-HIV therapeutic compounds substituted with carboxyl ester or phosphonate ester groups. Libraries of such compounds are screened optionally using the novel enzyme GS-7340 Ester Hydrolase. Compositions and methods relating to GS-7340 Ester Hydrolase also are provided.
    提供了一种鉴定含有羧酸酯或磷酸酯基团抗HIV治疗化合物的方法。可以选择使用新型酶GS-7340酯水解酶筛选这类化合物的文库。还提供了与GS-7340酯水解酶相关的组合物和方法。
  • [EN] COMPOSITES, METHODS AND USES THEREOF<br/>[FR] COMPOSITES, PROCÉDÉS ET UTILISATIONS ASSOCIÉS
    申请人:NAT UNIV SINGAPORE
    公开号:WO2021107872A1
    公开(公告)日:2021-06-03
    The present invention relates, in general terms, to methods of catalysing a reaction, including the steps of contacting a chemical entity comprising a sulphide moiety with a composite and an oxidant. The composite acts as a heterogeneous catalyst to oxidise the sulphide moiety. The present invention also relates to composites, methods of synthesising the composites and its use as a catalyst thereof.
    本发明总体上涉及催化反应的方法,包括将包含硫化物基团的化学实体与复合材料和氧化剂接触的步骤。该复合材料作为异质催化剂,用于氧化硫化物基团。本发明还涉及复合材料、合成该复合材料的方法及其作为催化剂的用途。
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