2-氯-1-(2,5-二甲基苯基)-(9ci)1-丙酮 | 88632-72-8

• 分子结构分类: 有机化合物 - 有机氧化合物
• 中文名称: 2-氯-1-(2,5-二甲基苯基)-(9ci)1-丙酮
• 英文名称: 2,5-dimethyl-α-chloropropiophenone
• 英文别名: 2-Chloro-1-(2,5-dimethylphenyl)propan-1-one
• CAS: 88632-72-8
• 化学式: C₁₁H₁₃ClO
• mdl: MFCD03988557
• 分子量: 196.677
• InChiKey: WJDFCWSMCKCWEU-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.4
• 重原子数：
  13
• 可旋转键数：
  2
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.363
• 拓扑面积：
  17.1
• 氢给体数：
  0
• 氢受体数：
  1

反应信息

• 作为反应物：
  描述：

  2-氯-1-(2,5-二甲基苯基)-(9ci)1-丙酮 生成 1-(2,5-二甲基苯基)-1-丙酮
  参考文献：
  名称：

  BERGMARK, W. R.;BARNES, C.;CLARK, J.;PAPARIAN, S.;MARYNOWSKI, S., J. ORG. CHEM., 1985, 50, N 26, 5612-5615

  摘要：

  DOI：
• 作为产物：
  描述：

  2-氯丙酰氯 、 对二甲苯 在 三氯化铝 作用下， 以72%的产率得到2-氯-1-(2,5-二甲基苯基)-(9ci)1-丙酮
  参考文献：
  名称：

  Photoenolization with .alpha.-chloro substituents

  摘要：

  DOI：

  10.1021/jo00350a036

文献信息

• Compounds and compositions
  申请人：ICI Australia Limited

  公开号：US04952722A1

  公开（公告）日：1990-08-28

  The invention concerns novel compounds of the formula I ##STR1## wherein: W are selected from alkyl, alkenyl and alkynyl; X are selected from halogen, nitro, cyano, alkyl, substituted alkyl, hydroxy, alkoxy, substituted alkoxy, alkenyl, alkynyl, alkenyloxy, alkynyloxy, acyloxy, alkoxycarbonyl, alkylthio, alkylsulfinyl, alkylsulfonyl, sulfamoyl, substituted sulfamoyl, amino, substituted amino, and the groups formyl and alkanoyl and the oxime and imine derivatives thereof, and an alkylene group which bridges two adjacent carbon atoms of the benzene ring; R.sup.1 is selected from hydrogen, alkyl, alkenyl, alkynyl, substituted alkyl, alkylsulfonyl, arylsulfonyl, acyl and an inorganic or organic cation; R.sup.2 is selected from alkyl, substituted alkyl, alkenyl, haloalkenyl, alkynyl and haloalkynyl; R.sup.3 is selected from alkyl, fluoroalkyl, alkenyl, alkynyl, and phenyl; p is zero or an integer selected form 1 to 4; n is zero or an integer selected from 1 to 3; and m is zero or an integer selected from 1 to 3. The compounds of the invention show cereal selective herbicidal properties and plant growth regulating properties and in further embodiments the invention provides processes for the preparation of the compounds of formula I, intermediates useful in the preparation of the compounds of formula I, compositions containing as active ingredient a compound of formula I, and herbicidal and plant growth regulating processes utilizing compounds of formula I.

  本发明涉及公式I的新化合物，其中： W选择自烷基，烯基和炔基; X选择自卤素，硝基，氰基，烷基，取代烷基，羟基，烷氧基，取代烷氧基，烯基，炔基，烯氧基，炔氧基，酰氧基，烷氧羰基，烷基硫醚，烷基亚砜，烷基磺酰基，磺酰胺，取代磺酰胺，氨基，取代氨基，以及酰肟和醛肟衍生物，和桥接苯环中两个相邻碳原子的烷基； R1选择自氢，烷基，烯基，炔基，取代烷基，烷基磺酰基，芳基磺酰基，酰基和无机或有机阳离子； R2选择自烷基，取代烷基，烯基，卤代烯基，炔基和卤代炔基； R3选择自烷基，氟烷基，烯基，炔基和苯基； p为零或从1到4选择的整数； n为零或从1到3选择的整数； m为零或从1到3选择的整数。 本发明的化合物表现出对谷类作物选择性除草和植物生长调节性能，并在进一步实施中提供了制备公式I化合物的过程，制备公式I化合物有用的中间体，含有公式I化合物作为活性成分的组合物，以及利用公式I化合物进行除草和植物生长调节的过程。
• Herbicidal compounds and compositions
  申请人：ICI Australia Limited

  公开号：US05110989A1

  公开（公告）日：1992-05-05

  The invention concerns novel compounds of the formula I ##STR1## wherein: W are selected from alkyl, alkenyl and alkynyl; X are selected from halogen, nitro, cyano, alkyl, substituted alkyl, hydroxy, alkoxy, substituted alkoxy, alkenyl, alkynyl, alkenyloxy, alkynyloxy, acyloxy, alkoxycarbonyl, alkylthio, alkylsulfinyl, alkylsulfonyl, sulfamoyl, substituted sulfamoyl, amino, substituted amino, and the groups formyl and alkanoyl and the oxime, imine and Schiff base derivatives thereof, and an alkylene group which bridges two adjacent carbon atoms of the benzene ring; R.sup.1 is selected from hydrogen, alkyl, alkenyl, alkynyl, substituted alkyl, alkylsulfonyl, arylsulfonyl, acyl and an inorganic or organic cation; R.sup.2 is selected from alkyl, substituted alkyl, alkenyl, haloalkenyl, alkynyl and haloalkynyl; R.sup.3 is selected from alkyl, fluoroalkyl, alkenyl, alkynyl, and phenyl; p is zero or an integer selected from 1 to 4; n is zero or an integer selected from 1 to 3; and m is zero or an integer selected from 1 to 3. The compounds of the invention show cereal selective herbicidal properties and plant growth regulating properties and in further embodiments the invention provides processes for the preparation of the compounds of formula I, intermediates useful in the preparation of the compounds of formula I, compositions containing as active ingredient a compound of formula I, and herbicidal and plant growth regulating processes utilizing compounds of formula I.

  本发明涉及公式I的新化合物，其中： W选自烷基，烯基和炔基； X选自卤素，硝基，氰基，烷基，取代烷基，羟基，烷氧基，取代烷氧基，烯基，炔基，烯氧基，炔氧基，酰氧基，烷氧羰基，烷基硫基，烷基亚磺酰基，烷基磺酰基，磺酰胺基，取代磺酰胺基，氨基，取代氨基，以及酰肟，亚胺和席夫碱衍生物，和一个桥接苯环中两个相邻碳原子的烷基； R1选自氢，烷基，烯基，炔基，取代烷基，烷基磺酰基，芳基磺酰基，酰基和无机或有机阳离子； R2选自烷基，取代烷基，烯基，卤代烯基，炔基和卤代炔基； R3选自烷基，氟代烷基，烯基，炔基和苯基； p为零或选自1到4的整数； n为零或选自1到3的整数； m为零或选自1到3的整数。 本发明的化合物表现出选择性杀草和植物生长调节性能，并在进一步的实施中，本发明提供了制备公式I化合物的过程，制备公式I化合物有用的中间体，包含公式I化合物作为活性成分的组合物，以及利用公式I化合物进行除草和植物生长调节的过程。
• Cyclohexanedione derivatives, their use as herbicides, herbicidal compositions containing them, and methods of preparing them
  申请人：ICI AUSTRALIA LIMITED

  公开号：EP0086588A2

  公开（公告）日：1983-08-24

  The invention concerns novel compounds of the formula I wherein: W are selected from alkyl, alkenyl and alkynyl; X are selected from halogen, nitro, cyano, alkyl, substituted alkyl, hydroxy, alkoxy, substituted alkoxy, alkenyl, alkynyl, alkenyloxy, alkynyloxy, acyloxy, alkoxycarbonyl, alkylthio, alkylsulfinyl, alkylsulfonyl, sulfamoyl, substituted sulfamoyl, amino, substituted amino, and the groups formyl and alkanoyl and the oxime, imine and Schiff base derivatives thereof, and an alkylene group which bridges two adjacent carbon atoms of the benzene ring; R1 is selected from hydrogen, alkyl, alkenyl, alkynyl, substituted alkyl, alkylsulfonyl, arylsulfonyl, acyl and an inorganic or organic cation; R2 is selected from alkyl, substituted alkyl, alkenyl, haloalkenyl, alkynyl and haloalkynyl; R3 is selected from alkyl, fluoroalkyl, alkenyl, alkynyl, and phenyl; p is zero or an integer selected from 1 to 4; n is zero or an integer selected from 1 to 3; and m is zero or an integer selected from 1 to 3. The compounds of the invention show cereal selective herbicidal properties and plant growth regulating properties and in further embodiments the invention provides processes for the preparation of the compounds of formula I, intermediates useful in the preparation of the compounds of formula I, compositions containing as active ingredient a compound of formula 1, and herbicidal and plant growth regulating processes utilizing compounds of formula I.

  本发明涉及式 I 的新型化合物 其中 W 选自烷基、烯基和炔基； X 选自卤素、硝基、氰基、烷基、取代烷基、羟基、烷氧基、取代烷氧基、烯基、炔基、烯氧基、炔氧基、酰氧基、烷氧基羰基、烷硫基、烷基亚磺酰基、烷基磺酰基、氨基磺酰基、取代氨基磺酰基、氨基、取代氨基、甲酰基和烷酰基及其肟、亚胺和希夫碱衍生物，以及连接苯环上两个相邻碳原子的亚烷基； R1 选自氢、烷基、烯基、炔基、取代烷基、烷基磺酰基、芳基磺酰基、酰基和无机或有机阳离子； R2 选自烷基、取代烷基、烯基、卤代烯基、炔基和卤代炔基； R3 选自烷基、氟烷基、烯基、炔基和苯基； p 为零或选自 1 至 4 的整数； n 为零或选自 1 至 3 的整数；以及 m 为零或选自 1 至 3 的整数。 本发明的化合物具有谷物选择性除草特性和植物生长调节特性，在进一步的实施方案中，本发明提供了制备式 I 化合物的工艺、用于制备式 I 化合物的中间体、含有式 1 化合物作为活性成分的组合物，以及利用式 I 化合物的除草和植物生长调节工艺。
• ——
  作者：SERBAN A.、 WATSON K. G.、 BIRD G. J.、 CROSS L. E.、 FARQUHARSON G. J.

  DOI：——

  日期：——
• US4952722A
  申请人：——

  公开号：US4952722A

  公开（公告）日：1990-08-28