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1,1-Bis(phenylthio)-2-methyl-1-octen-4-yl acetate | 157955-31-2

中文名称
——
中文别名
——
英文名称
1,1-Bis(phenylthio)-2-methyl-1-octen-4-yl acetate
英文别名
[2-Methyl-1,1-bis(phenylsulfanyl)oct-1-en-4-yl] acetate
1,1-Bis(phenylthio)-2-methyl-1-octen-4-yl acetate化学式
CAS
157955-31-2
化学式
C23H28O2S2
mdl
——
分子量
400.606
InChiKey
WXUOLKBMBNICII-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):
    7.7
  • 重原子数:
    27
  • 可旋转键数:
    11
  • 环数:
    2.0
  • sp3杂化的碳原子比例:
    0.35
  • 拓扑面积:
    76.9
  • 氢给体数:
    0
  • 氢受体数:
    4

反应信息

  • 作为反应物:
    描述:
    1,1-Bis(phenylthio)-2-methyl-1-octen-4-yl acetate 生成 (S)-1,1-Bis(phenylthio)-2-methyl-1-octen-4-ol
    参考文献:
    名称:
    Pai Yuan-Chi, Fang Jim-Min, Wu Shih-Hsiung, J. Org. Chem, 59 (1994) N 20, S 6018-6025
    摘要:
    DOI:
  • 作为产物:
    描述:
    1,1-bis(phenylthio)-2-methylpropene 在 4-二甲氨基吡啶正丁基锂三乙胺 作用下, 以 四氢呋喃二氯甲烷 为溶剂, 反应 1.67h, 生成 1,1-Bis(phenylthio)-2-methyl-1-octen-4-yl acetate
    参考文献:
    名称:
    Resolution of Homoallylic Alcohols Containing Dithioketene Acetal Functionalities. Synthesis of Optically Active .gamma.-Lactones by a Combination of Chemical and Enzymic Methods
    摘要:
    Racemic homoallylic alcohols 1-3 containing dithioketeneacetal functionalities were prepared by addition of aldehydes to the allylic anions of ketene dithioacetals or 2-alkenyl-1,3-dithiane in a regio- and stereoselective manner. Lipase-catalyzed hydrolyses of the corresponding acetates 7-9 afforded optically active alcohols 1-3, which were treated with mercuric chloride to give gamma-lactones such as natural hop lactone, whiskey lactone, and cognac lactone.
    DOI:
    10.1021/jo00099a036
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文献信息

  • Pai Yuan-Chi, Fang Jim-Min, Wu Shih-Hsiung, J. Org. Chem, 59 (1994) N 20, S 6018-6025
    作者:Pai Yuan-Chi, Fang Jim-Min, Wu Shih-Hsiung
    DOI:——
    日期:——
  • Resolution of Homoallylic Alcohols Containing Dithioketene Acetal Functionalities. Synthesis of Optically Active .gamma.-Lactones by a Combination of Chemical and Enzymic Methods
    作者:Yuan-Chi Pai、Jim-Min Fang、Shih-Hsiung Wu
    DOI:10.1021/jo00099a036
    日期:1994.10
    Racemic homoallylic alcohols 1-3 containing dithioketeneacetal functionalities were prepared by addition of aldehydes to the allylic anions of ketene dithioacetals or 2-alkenyl-1,3-dithiane in a regio- and stereoselective manner. Lipase-catalyzed hydrolyses of the corresponding acetates 7-9 afforded optically active alcohols 1-3, which were treated with mercuric chloride to give gamma-lactones such as natural hop lactone, whiskey lactone, and cognac lactone.
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