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6-十三醇 | 5770-03-6

中文名称
6-十三醇
中文别名
——
英文名称
tridecan-6-ol
英文别名
6-tridecanol
6-十三醇化学式
CAS
5770-03-6
化学式
C13H28O
mdl
——
分子量
200.365
InChiKey
HAIXKKLECRWLIX-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

物化性质

  • 熔点:
    26.15°C (estimate)
  • 沸点:
    268.11°C (estimate)
  • 密度:
    0.7947 (estimate)
  • 保留指数:
    1570
  • 稳定性/保质期:
    存在于烟气中。

计算性质

  • 辛醇/水分配系数(LogP):
    5.4
  • 重原子数:
    14
  • 可旋转键数:
    10
  • 环数:
    0.0
  • sp3杂化的碳原子比例:
    1.0
  • 拓扑面积:
    20.2
  • 氢给体数:
    1
  • 氢受体数:
    1

安全信息

  • 安全说明:
    S24/25

SDS

SDS:66f6433a1598ba002ae88c37598458ca
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反应信息

  • 作为反应物:
    描述:
    6-十三醇 在 CuBr2-LiOt-Bu 作用下, 以 四氢呋喃 为溶剂, 反应 4.0h, 以89%的产率得到6-十三烷酮
    参考文献:
    名称:
    CuBr2–LiOButas 一种用于醇类氧化的新试剂
    摘要:
    发现标题试剂能促进醇的氧化,以良好的收率得到相应的羰基化合物。铜(II)氧化剂很容易通过溴化铜(II)与叔丁醇锂在 THF 中反应制备。
    DOI:
    10.1246/cl.1992.1185
  • 作为产物:
    描述:
    6-十三烷酮 在 lithium aluminium tetrahydride 作用下, 生成 6-十三醇
    参考文献:
    名称:
    Baykut; Oezeris, Istanbul Universitesi Fen Fakultesi Mecmuasi, Seri C: [Astronomi-Fizik-Kimya], 1957, vol. 22, p. 32,37
    摘要:
    DOI:
点击查看最新优质反应信息

文献信息

  • Diarylalkanes as potent inhibitors of binuclear enzymes
    申请人:Jia Qi
    公开号:US20050267047A1
    公开(公告)日:2005-12-01
    The present invention implements a strategy that combines an enzyme inhibition assay with a chemical dereplication process to identify active plant extracts and the particular compounds—diarylalkanes and/or diarylalkanols within those extracts that specifically inhibit binuclear enzyme function. Included in the present invention are compositions of matter comprised of one or more of diarylalkanes and/or diarylalkanols, which inhibit the activity of binuclear enzymes, particularly tyrosinase and which prevent melanin overproduction. The present invention also provides a method for inhibiting the activity of a binuclear enzyme, particularly tyrosinase and a method for preventing and treating diseases and conditions related to binuclear enzyme function. The present invention further includes a method for preventing and treating melanin overproduction and diseases and conditions of the skin related thereto. The method for preventing and treating diseases and conditions related to binuclear enzyme function and melanin overproduction is comprised of administering to a host in need thereof an effective amount of a composition comprising one or more diarylalkanes and/or diarylalkanols synthesized and/or isolated from one or more plants together with a pharmaceutically acceptable carrier.
    本发明实施了一种策略,将酶抑制测定与化学去重复过程相结合,以识别活性植物提取物和特定化合物——二芳基烷烃和/或二芳基醇,这些化合物特异性地抑制双核酶功能。本发明包括由一种或多种二芳基烷烃和/或二芳基醇组成的物质组合物,其抑制双核酶的活性,特别是酪氨酸酶,并防止黑色素过度产生。本发明还提供了一种抑制双核酶活性的方法,特别是酪氨酸酶,以及一种预防和治疗与双核酶功能相关的疾病和病况的方法。本发明还包括一种预防和治疗黑色素过度产生以及与之相关的皮肤疾病和病况的方法。预防和治疗与双核酶功能和黑色素过度产生相关的疾病和病况的方法包括向需要的宿主施用由一种或多种植物合成和/或分离的一种或多种二芳基烷烃和/或二芳基醇组成的组合物的有效量,以及药用载体。
  • Direct Dehydroxytrifluoromethylthiolation of Alcohols Using Silver(I) Trifluoromethanethiolate and Tetra-<i>n</i>-butylammonium Iodide
    作者:Jian-Bo Liu、Xiu-Hua Xu、Zeng-Hao Chen、Feng-Ling Qing
    DOI:10.1002/anie.201409983
    日期:2015.1.12
    reaction for the direct trifluoromethylthiolation and fluorination of alkyl alcohols using AgSCF3 and nBu4NI has been developed. The trifluoromethylthiolated compounds and alkyl fluorides were selectively formed by changing the ratio of AgSCF3/nBu4NI. This protocol is tolerant of different functional groups and might be applicable to late‐stage trifluoromethylthiolation of alcohols.
    已经开发了使用AgSCF 3和nBu 4 NI进行烷基醇的直接三氟甲基硫醇化和氟化的前所未有的反应。通过改变AgSCF 3 / nBu 4 NI的比例选择性地形成三氟甲基硫醇化的化合物和烷基氟化物。该方案可耐受不同的官能团,并且可能适用于醇的晚期三氟甲基硫醇化。
  • A User-Friendly Procedure for the Preparation of Secondary Alkyl Chlorides
    作者:Gérard Cahiez、Nicolas Lefèvre、Maël Poizat、Alban Moyeux
    DOI:10.1055/s-0032-1317927
    日期:——
    Abstract Secondary alkyl chlorides have been efficiently prepared from secondary alkyl sulfonates under mild and user-friendly conditions. The exchange reaction was generally performed by using benzyltributylammonium chloride in acetone (reflux, 30 min). Yields are excellent from functionalized, base-sensitive and hindered secondary alkyl sulfonates. Secondary alkyl chlorides have been efficiently
    摘要 已经在温和且用户友好的条件下由仲烷基磺酸盐有效地制备了仲烷基氯。交换反应通常通过在丙酮中使用苄基三丁基氯化铵进行(回流,30分钟)进行。从官能化的,对碱敏感的和受阻的仲烷基磺酸盐中,收率很高。 已经在温和且用户友好的条件下由仲烷基磺酸盐有效地制备了仲烷基氯。交换反应通常通过在丙酮中使用苄基三丁基氯化铵进行(回流,30分钟)进行。从官能化的,对碱敏感的和受阻的仲烷基磺酸盐中,收率很高。
  • Efficient Procedures to Prepare Primary and Secondary Alkyl Halides from Alkanols via the Corresponding Sulfonates under Mild Conditions
    作者:Gérard Cahiez、Olivier Gager、Alban Moyeux、Thomas Delacroix
    DOI:10.1002/adsc.201100736
    日期:2012.5.21
    herein shows that sulfonate/halide exchange can be advantageously performed in THF to avoid several side reactions such as elimination and epimerization when the reaction is performed from a chiral alkyl sulfonate or a substrate having a CH acidic chiral center. The main limitation of this procedure was found to be the conversion of secondary alkyl sulfonates to alkyl chlorides. In this case, the
    该研究本文中所呈现显示,磺酸盐/卤化物交换可以有利地在THF中,当反应是由具有一个C手性烷基磺酸盐或衬底进行执行,以避免几副反应,例如消除和差向异构化 ħ酸性手性中心。发现该方法的主要限制是仲烷基磺酸盐向烷基氯化物的转化。在这种情况下,加入催化量的氯化锰明显加快了反应速度和效率。
  • DIARYLALKANES AS POTENT INHIBITORS OF BINUCLEAR ENZYMES
    申请人:Unigen, Inc.
    公开号:US20140371491A1
    公开(公告)日:2014-12-18
    The present invention implements a strategy that combines an enzyme inhibition assay with a chemical dereplication process to identify active plant extracts and the particular compounds—diarylalkanes and/or diarylalkanols within those extracts that specifically inhibit binuclear enzyme function. Included in the present invention are compositions of matter comprised of one or more of diarylalkanes and/or diarylalkanols, which inhibit the activity of binuclear enzymes, particularly tyrosinase and which prevent melanin overproduction. The present invention also provides a method for inhibiting the activity of a binuclear enzyme, particularly tyrosinase and a method for preventing and treating diseases and conditions related to binuclear enzyme function. The present invention further includes a method for preventing and treating melanin overproduction and diseases and conditions of the skin related thereto. The method for preventing and treating diseases and conditions related to binuclear enzyme function and melanin overproduction is comprised of administering to a host in need thereof an effective amount of a composition comprising one or more diarylalkanes and/or diarylalkanols synthesized and/or isolated from one or more plants together with a pharmaceutically acceptable carrier.
    本发明实施了一种策略,将酶抑制测定与化学去重过程相结合,以鉴定活性植物提取物及其中特定化合物——二芳基烷烃和/或二芳基烷醇,其特异性抑制双核酶功能。本发明包括由一种或多种二芳基烷烃和/或二芳基烷醇组成的物质组合物,其抑制双核酶的活性,特别是酪氨酸酶,从而防止黑色素过度产生。本发明还提供了一种抑制双核酶活性的方法,特别是酪氨酸酶,并提供了一种预防和治疗与双核酶功能相关的疾病和病症的方法。本发明还包括一种预防和治疗黑色素过度产生及其相关皮肤疾病和病症的方法。预防和治疗与双核酶功能和黑色素过度产生相关的疾病和病症的方法包括向需要的宿主施用一种由一种或多种从一种或多种植物中合成和/或分离出的二芳基烷烃和/或二芳基烷醇组成的组合物的有效量,以及药学上可接受的载体。
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表征谱图

  • 氢谱
    1HNMR
  • 质谱
    MS
  • 碳谱
    13CNMR
  • 红外
    IR
  • 拉曼
    Raman
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mass
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ir
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  • 峰位数据
  • 峰位匹配
  • 表征信息
Shift(ppm)
Intensity
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Assign
Shift(ppm)
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测试频率
样品用量
溶剂
溶剂用量
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