2-propylpentyl nitrate | 1309658-65-8

• 分子结构分类: 有机化合物 - 有机氧化合物 - 有机含氧阴离子化合物
• 英文名称: 2-propylpentyl nitrate
• CAS: 1309658-65-8
• 化学式: C₈H₁₇NO₃
• 分子量: 175.228
• InChiKey: PWFNFGAAHFAYNM-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.6
• 重原子数：
  12
• 可旋转键数：
  6
• 环数：
  0.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  55
• 氢给体数：
  0
• 氢受体数：
  3

文献信息

• Nitrate Esters and Their Use For The Treatment of Muscle and Muscle Related Diseases
  申请人：Wang Guqi

  公开号：US20110130455A1

  公开（公告）日：2011-06-02

  Alkyl nitrate ester compounds are provided for the delivery of nitric oxide to targeted muscle tissues, and in particular, to normal and dystrophic muscles. In one aspect, nitrate ester compounds are provided having the following formula: wherein, R 1 is ONO 2 , CH 2 ONO 2 , C n H 2n+1 OH, C n H 2n+1 OH, or CH 2 CH 2 CH 3 , or H; R 2 is ONO 2 , CH 2 ONO 2 , C n′ H 2n′+1 OH, C n′ H 2n′+1 OH, CH 2 CH 2 CH 3 or H; and R 3 is ONO 2 , CH 2 ONO 2 , C n′″ H 2n″+1 OH, C n″ H 2n″+1 OH, CH 2 CH 2 CH 3 or H; wherein n is an integer from 0 to 9, n′ is an integer from 0 to 9, and n″ is an integer from 0 to 9, and n+n′+n″≦9, and wherein at least one of R 1 , R 2 , and R 3 is an ester nitrate selected from the group consisting of ONO 2 , CH 2 ONO 2 , and combinations thereof.

  提供了烷基硝酸酯化合物，用于将一氧化氮传递到靶向肌肉组织，特别是正常和萎缩肌肉。在一个方面，提供了具有以下公式的硝酸酯化合物：其中，R1为ONO2，CH2ONO2，CnH2n+1OH，CnH2n+1OH，或CH2CH2CH3，或H；R2为ONO2，CH2ONO2，Cn′H2n′+1OH，Cn′H2n′+1OH，CH2CH2CH3或H；和R3为ONO2，CH2ONO2，Cn′″H2n″+1OH，Cn″H2n″+1OH，CH2CH2CH3或H；其中n为0至9的整数，n′为0至9的整数，n″为0至9的整数，且n+n′+n″≦9，且其中至少一个R1、R2和R3是从ONO2、CH2ONO2和它们的组合中选择的酯硝酸盐。
• Nitrate esters and their use for the treatment of muscle and muscle related diseases
  申请人：The Charlotte-Mecklenburg Hospital Authority

  公开号：EP2329862B1

  公开（公告）日：2016-03-30
• Nitrate Esters And Their Use For The Treatment Of Muscle And Muscle Related Diseases
  申请人：Wang Guqi

  公开号：US20120309825A1

  公开（公告）日：2012-12-06

  Alkyl nitrate ester compounds are provided for the delivery of nitric oxide to targeted muscle tissues, and in particular, to normal and dystrophic muscles. In one aspect, nitrate ester compounds are provided having the following formula: wherein, R 1 is ONO 2 , CH 2 ONO 2 , C n H 2n+1 OH, C n H 2n+1 OH, CH 3 , CH 2 CH 3 , CH 2 CH 2 CH 3 , or H; R 2 is ONO 2 , CH 2 ONO 2 , C n′ H 2n′+1 OH, C n′ H 2n′+1 OH, CH 3 , CH 2 CH 3 , CH 2 CH 2 CH 3 , or H; R 3 is ONO 2 , CH 2 ONO 2 , C n′″ H 2n″+1 OH, C n″ H 2n″+1 OH, CH 3 , CH 2 CH 3 , CH 2 CH 2 CH 3 , or H; and R 4 is ONO 2 , CH 2 ONO 2 , C n′″ H 2n″+1 OH, C n″ H 2n″+1 OH, CH 3 , CH 2 CH 3 , CH 2 CH 2 CH 3 , or H; wherein n is an integer from 0 to 9, n′ is an integer from 0 to 9, and n″ is an integer from 0 to 9, and n+n′+n″≦9, and wherein at least one of R 1 , R 2 , and R 3 is an ester nitrate selected from the group consisting of ONO 2 , CH 2 ONO 2 , and combinations thereof.
• US9023890B2
  申请人：——

  公开号：US9023890B2

  公开（公告）日：2015-05-05
• US9452117B2
  申请人：——

  公开号：US9452117B2

  公开（公告）日：2016-09-27