1-(8-chloro-5-phenyl-2,3,4,5-tetrahydro-1,6-benzothiazocin-6-yl)ethanone

1-(8-chloro-5-phenyl-2,3,4,5-tetrahydro-1,6-benzothiazocin-6-yl)ethanone 基本信息
CAS号 87697-14-1 分子式 C18H18ClNOS
分子量 331.86000 精确质量  331.08000
PSA  45.61000 LogP  5.38510

基本信息 展开↓

CAS号:
87697-14-1
3D弹球模型:
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分子式:
C18H18ClNOS
分子量:
331.86000
中文名称:
1-(8-chloro-5-phenyl-2,3,4,5-tetrahydro-1,6-benzothiazocin-6-yl)ethanone
英文名称:
1-(8-chloro-5-phenyl-2,3,4,5-tetrahydro-1,6-benzothiazocin-6-yl)ethanone
中文别名:
1-(8-chloro-5-phenyl-2,3,4,5-tetrahydro-1,6-benzothiazocin-6-yl)ethanone
英文别名:
1-(8-chloro-5-phenyl-2,3,4,5-tetrahydro-1,6-benzothiazocin-6-yl)ethanone;
2H-1,6-Benzothiazocine,6-acetyl-8-chloro-3,4,5,6-tetrahydro-5-phenyl;
6-acetyl-8-chloro-3,4,5,6-tetrahydro-5-phenyl-2h-1,6-benzothiazocine
精确分子量/精确质量:
331.08000
极性分子表面积/PSA:
45.61000
油水分配系数/LogP:

LogP值指的是某物质在正辛醇/水两相体系中的分配系数的对数值,反映了物质在油水两相中的分配情况。其中、LogP值越大,说明该物质越亲油;反之,LogP值越小,则说明该物质越亲水。
InChI:
The Key: GGZBOWJDWWTGGF-UHFFFAOYSA-N

合成路线查看所有的合成路线

  • 108-24-7

    乙酸酐

  • +

  • 87697-05-0

    8-chloro-5-phenyl-3,4,5,6-tetrahydro-2H-1,6-benzothiazocine

  • ~91%

  • 87697-14-1

    1-(8-chloro-5-phenyl-2,3,4,5-tetrahydro-1,6-benzothiazocin-6-yl)ethanone

  • 76293-52-2

    8-chloro-5-phenyl-3,4-dihydro-2H-1,6-benzothiazocine

  • 87697-14-1

    1-(8-chloro-5-phenyl-2,3,4,5-tetrahydro-1,6-benzothiazocin-6-yl)ethanone

  • 939-52-6

    4-氯苯丁酮

  • 87697-14-1

    1-(8-chloro-5-phenyl-2,3,4,5-tetrahydro-1,6-benzothiazocin-6-yl)ethanone

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  • 87696-89-7

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  • 939-52-6

    4-氯苯丁酮

  • 108-24-7

    乙酸酐

  • 87697-05-0

    8-chloro-5-phenyl-3,4,5,6-tetrahydro-2H-1,6-benzothiazocine

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