1-aminobenzonorbornadiene | 91879-72-0

• 分子结构分类: 有机化合物 - 苯类化合物 - 萘
• 英文名称: 1-aminobenzonorbornadiene
• 英文别名: Tricyclo[6.2.1.02,7]undeca-2,4,6,9-tetraen-1-amine
• CAS: 91879-72-0
• 化学式: C₁₁H₁₁N
• 分子量: 157.215
• InChiKey: UNRLTEZNYSKYSY-UHFFFAOYSA-N

物化性质

• 沸点：
  252.9±29.0 °C(Predicted)
• 密度：
  1.203±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  1.4
• 重原子数：
  12
• 可旋转键数：
  0
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.27
• 拓扑面积：
  26
• 氢给体数：
  1
• 氢受体数：
  1

反应信息

• 作为反应物：
  描述：

  1-aminobenzonorbornadiene 在 三乙胺 、 苯乙酮 作用下， 以 苯 为溶剂， 反应 0.08h， 生成 C₁₃H₁₃NO
  参考文献：
  名称：

  通过桥头取代基在二苯甲茚和苯并降冰片二烯的二-π-甲烷重排中有效控制区域选择性

  摘要：

  通过 l'etat 三重态苯并降冰片二烯单取代基和 deux benzobarrelenes isotopiquement 取代基进行光异构化。L'analysis de l'effet substituant pipe a la proposal de deux mecanismes

  DOI：

  10.1021/ja00334a039
• 作为产物：
  描述：

  3-氯苯甲酰乙腈 、 (1-benzonorbornadiene)-magnesium bromide 在 magnesium 作用下， 以 四氢呋喃 为溶剂， 反应 0.5h， 以21%的产率得到1-aminobenzonorbornadiene
  参考文献：
  名称：

  通过桥头取代基在二苯甲茚和苯并降冰片二烯的二-π-甲烷重排中有效控制区域选择性

  摘要：

  通过 l'etat 三重态苯并降冰片二烯单取代基和 deux benzobarrelenes isotopiquement 取代基进行光异构化。L'analysis de l'effet substituant pipe a la proposal de deux mecanismes

  DOI：

  10.1021/ja00334a039

文献信息

• PROCESS FOR THE PRODUCTION OF AROMATIC AMINDES IN THE PRESENCE OF A PALLADIUM COMPLEX COMPRISING A FERROCENYL BIPHOSPHINE LIGAND
  申请人：Walter Harald

  公开号：US20100256417A1

  公开（公告）日：2010-10-07

  The present invention relates to a process for the preparation of compounds of Formula (I), wherein R 1 is 1,3-dimethyl-butyl, 1,3,3-trimethyl-butyl or a group A 1 , wherein R 3 , R 4 and R 5 are each independently of the others hydrogen or C 1 -C 4 alkyl; and R 2 is hydrogen; or R 1 and R 2 together from the group A 2 , wherein R 6 , and R7 are each independently of the other hydrogen or C 1 -C 4 alkyl; or R 1 and R 2 together from the group A 3 , wherein R 5 and R 9 are each independently of the other hydrogen or C 1 -C 4 alkyl; wherein a compound of Formula (II) wherein R 1 and R 2 are as defined for formula I and X is bromine or chlorine, is reacted with ammonia in the presence of a base and a catalytic amount of at least one palladium complex compound, wherein the palladium complex compound comprises at least one ferrocenyl-biphosphine ligand.

  本发明涉及一种制备式（I）化合物的方法，其中R1为1,3-二甲基丁基、1,3,3-三甲基丁基或A1基团，其中R3、R4和R5各自独立地为氢或C1-C4烷基；R2为氢；或者R1和R2一起形成A2基团，其中R6和R7各自独立地为氢或C1-C4烷基；或者R1和R2一起形成A3基团，其中R5和R9各自独立地为氢或C1-C4烷基；其中化合物式（II）其中R1和R2如式（I）所定义，X为溴或氯，在碱和至少一种钯配合物催化剂的存在下与氨反应，其中钯配合物包括至少一种二茂铁双膦配体。
• [EN] HETEROCYCLOCARBOXAMIDE DERIVATIVES<br/>[FR] DERIVES D'HETEROCYCLOCARBOXAMIDE
  申请人：SYNGENTA PARTICIPATIONS AG

  公开号：WO2004035589A1

  公开（公告）日：2004-04-29

  The invention relates to a fungicidally active compound of formula (I): where Het is a 5- or 6-membered heterocyclic ring containing one to three heteroatoms, each independently selected from oxygen, nitrogen and sulphur, provided that the ring is not 1,2,3-triazole, the ring being substituted by groups R8, R9 and R10; X is a single or double bond; Y is O, S, N(R11) or (CR12R13)(CR14R15)m(CR16R17)n; m is 0 or 1; n is 0 or 1; and R1 to R17 each, independently, have a range of values; to the preparation of these compounds, to novel intermediates used in the preparation of these compounds, to agrochemical compositions which comprise at least one of the novel compounds as active ingredient, to the preparation of the compositions mentioned and to the use of the active ingredients or compositions in agriculture or horticulture for controlling or preventing infestation of plants by phytopathogenic microorganisms, preferably fungi.

  本发明涉及一种式(I)的真菌杀菌活性化合物：其中Het是一个含有1-3个杂原子的5-或6元杂环，每个杂原子独立地选自氧、氮和硫，前提是该环不是1,2,3-三唑环，该环被R8、R9和R10基取代；X是单键或双键；Y是O、S、N(R11)或(CR12R13)(CR14R15)m(CR16R17)n；m为0或1；n为0或1；R1至R17各自独立地具有一系列值；制备这些化合物，用于制备这些化合物的新中间体，农业化学组合物，其中至少包含一种新化合物作为活性成分，制备所述组合物和在农业或园艺中使用活性成分或组合物控制或预防植物被植物病原微生物，优选真菌的侵染。
• HETEROCYCLOCARBOXAMIDE DERIVATIVES
  申请人：Syngenta Participations AG

  公开号：EP1556385B1

  公开（公告）日：2010-03-10
• Heterocyclocarboxamide Derivatives
  申请人：Ehrenfreund Josef

  公开号：US20080051446A1

  公开（公告）日：2008-02-28

  The invention relates to a fungicidally active compound of formula (I): where Het is a 5- or 6-membered heterocyclic ring containing one to three heteroatoms, each independently selected from oxygen, nitrogen and sulphur, provided that the ring is not 1,2,3-triazole, the ring being substituted by groups R 8 , R 9 and R 10 ; X is a single or double bond; Y is O, S, N(R 11 ) or (CR 12 R 13 )(CR 14 R 15 ) m (CR 16 R 17) n ; m is 0 or 1; n is 0 or 1; and R 1 to R 17 each, independently, have a range of values; to the preparation of these compounds, to novel intermediates used in the preparation of these compounds, to agrochemical compositions which comprise at least one of the novel compounds as active ingredient, to the preparation of the compositions mentioned and to the use of the active ingredients or compositions in agriculture or horticulture for controlling or preventing infestation of plants by phytopathogenic microorganisms, preferably fungi.
• US7598395B2
  申请人：——

  公开号：US7598395B2

  公开（公告）日：2009-10-06