4-methyl-5-oxo-2,3-dihydro-1-benzothiepine-4-carbonitrile

4-methyl-5-oxo-2,3-dihydro-1-benzothiepine-4-carbonitrile 基本信息
CAS号 88267-26-9 分子式 C12H11NOS
分子量 217.28700 精确质量  217.05600
PSA  66.16000 LogP  2.89498

基本信息 展开↓

CAS号:
88267-26-9
3D弹球模型:
立即前往扯扯看
分子式:
C12H11NOS
分子量:
217.28700
英文名称:
4-methyl-5-oxo-2,3-dihydro-1-benzothiepine-4-carbonitrile
英文别名:
4-methyl-5-oxo-2,3-dihydro-1-benzothiepine-4-carbonitrile;
1-Benzothiepin-4-carbonitrile,2,3,4,5-tetrahydro-4-methyl-5-oxo
精确分子量/精确质量:
217.05600
极性分子表面积/PSA:
66.16000
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: FGPVEFNLOMWXAW-UHFFFAOYSA-N

合成路线查看所有的合成路线

  • 88267-23-6

    5-oxo-3,4-dihydro-2H-1-benzothiepine-4-carbonitrile

  • +

  • 74-88-4

    甲基碘

  • ~86%

  • 88267-26-9

    4-methyl-5-oxo-2,3-dihydro-1-benzothiepine-4-carbonitrile

  • 21609-70-1

    3,4-dihydro-2H-1-benzothiepin-5-one

  • 88267-26-9

    4-methyl-5-oxo-2,3-dihydro-1-benzothiepine-4-carbonitrile

  • 40322-47-2

    4-(hydroxymethylidene)-2,3-dihydro-1-benzothiepin-5-one

  • 88267-26-9

    4-methyl-5-oxo-2,3-dihydro-1-benzothiepine-4-carbonitrile

上下游相关产品

上游产品

更多
  • 88267-23-6

    5-oxo-3,4-dihydro-2H-1-benzothiepine-4-carbonitrile

  • 74-88-4

    甲基碘

  • 40322-47-2

    4-(hydroxymethylidene)-2,3-dihydro-1-benzothiepin-5-one

  • 21609-70-1

    3,4-dihydro-2H-1-benzothiepin-5-one

下游产品

更多
  • 88267-36-1

    4-methyl-5-oxo-2,3-dihydro-1-benzothiepine-4-carboxamide

  • 88267-33-8

    4-methoxycarbonyl-4-methyl-3,4-dihydro-1-benzothiepin-5(2H)-one

  • 89650-13-5

    3-(4-methyl-5-oxo-2,3-dihydro-1-benzothiepin-4-yl)propanoic acid

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