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(1-Oxo-1-phenylhex-5-yn-2-yl)carbamic acid

中文名称
——
中文别名
——
英文名称
(1-Oxo-1-phenylhex-5-yn-2-yl)carbamic acid
英文别名
(1-oxo-1-phenylhex-5-yn-2-yl)carbamic acid
(1-Oxo-1-phenylhex-5-yn-2-yl)carbamic acid化学式
CAS
——
化学式
C13H13NO3
mdl
——
分子量
231.25
InChiKey
XDAVHOQCCJCHOJ-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
  • 重原子数:
    17
  • 可旋转键数:
    5
  • 环数:
    1.0
  • sp3杂化的碳原子比例:
    0.23
  • 拓扑面积:
    66.4
  • 氢给体数:
    2
  • 氢受体数:
    3

文献信息

  • BIOCATALYSTS FOR THE PREPARATION OF HYDROXY SUBSTITUTED CARBAMATES
    申请人:Codexis, Inc.
    公开号:EP2780448B1
    公开(公告)日:2019-09-11
  • IMMOBILIZED KETOREDUCTASES AND PROCESS FOR MAKING AND USING IMMOBILIZED KETOREDUCTASE
    申请人:Merck Sharp & Dohme Corp.
    公开号:EP2970927A1
    公开(公告)日:2016-01-20
  • [EN] IMMOBILIZED KETOREDUCTASES AND PROCESS FOR MAKING AND USING IMMOBILIZED KETOREDUCTASE<br/>[FR] CÉTORÉDUCTASES IMMOBILISÉES ET PROCÉDÉ DE FABRICATION ET D'UTILISATION DE CÉTORÉDUCTASE IMMOBILISÉE
    申请人:MERCK SHARP & DOHME
    公开号:WO2014150633A1
    公开(公告)日:2014-09-25
    The invention is directed to immobilized ketoreductases and methods of making and using them. Enzymes are protein molecules which serve to accelerate the chemical reactions of living cells (often by several orders of magnitude). Without enzymes, most biochemical reactions would be too slow to even carry out life processes. Enzymes display great specificity and are not permanently modified by their participation in reactions. Since they are not changed during the reactions, enzymes can be cost effectively used as catalysts for a desired chemical transformation.
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