2-butenyloxyamine hydrochloride | 113211-42-0

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 2-butenyloxyamine hydrochloride
• 英文别名: crotyloxyamine hydrochloride；O-crotyl hydroxylamine hydrochloride；O-But-2-enyl-hydroxylamine hydrochloride；O-[(E)-but-2-enyl]hydroxylamine;hydrochloride
• CAS: 113211-42-0
• 化学式: C₄H₉NO*ClH
• 分子量: 123.582
• InChiKey: OPJFWQSEOAELRV-SQQVDAMQSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.87
• 重原子数：
  7
• 可旋转键数：
  2
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.5
• 拓扑面积：
  35.2
• 氢给体数：
  2
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  5,6-二甲氧基茚酮 、 2-butenyloxyamine hydrochloride 在 sodium acetate 作用下， 以 乙醇 为溶剂， 反应 2.0h， 以95%的产率得到5,6-dimethoxyindan-1-one oxime O-crotyl ether
  参考文献：
  名称：

  Synthesis of 5,6,7,8-Tetrahydroquinolines by Thermolysis of Oxime O-Allyl Ethers in the Presence of Boron Trifluoride Etherate.

  摘要：

  环己酮肟 O-巴豆基和 O-肉桂基醚在 BF3-醚化物存在下区域选择性地热解得到 4-甲基-和 4-苯基-5,6,7,8-四氢喹啉，同时加入有机碱如三乙胺和吡啶抑制重排。这些发现表明，酸的添加使 O-烯丙基醚的两种可能的转变（[1, 2] 和 [2, 3] 转变）中的主要转变之一发生了 [1, 2] 转变。

  DOI：

  10.1248/cpb.41.1297
• 作为产物：
  描述：

  (E)-2-(but-2-en-1-yloxy)isoindoline-1,3-dione 、 肼 生成 2-butenyloxyamine hydrochloride
  参考文献：
  名称：

  IRIE H.; KATAYAMA I.; MIZUNO Y.; KOYAMA J.; SUZUTA Y., HETEROCYCLES, 1979, 12, NO 6, 771-773

  摘要：

  DOI：

文献信息

• Certain pyridyl thio or phenyl thio-E thane-1,3-cyclohexane
  申请人：Sumitomo Chemical Company, Limited

  公开号：US04789396A1

  公开（公告）日：1988-12-06

  A novel cyclohexane compound represented by the general formula (I), ##STR1## wherein R.sup.1 represents a hydrogen atom or a (C.sub.1 -C.sub.6)alkyl or (C.sub.1 -C.sub.4)alkoxymethyl group, R.sup.2 represents a (C.sub.1 -C.sub.12)alkyl, (C.sub.3 -C.sub.6)alkenyl, (C.sub.3 -C.sub.6)alkynyl, (C.sub.3 -C.sub.6)cycloalkylmethyl, halo(C.sub.3 -C.sub.6)alkenyl, cyano(C.sub.1 -C.sub.4)alkyl, (C.sub.1 -C.sub.4)alkoxymethyl, (C.sub.1 -C.sub.4)alkylthiomethyl or benzyl group, R.sup.3 represents a hydrogen atom or a methyl group, R.sup.4 represents a hydrogen atom or a methyl group, R.sup.5 is a hydrogen atom or a methyl group, and when R.sup.5 is a hydrogen atom, R.sup.6 is a hydrogen atom or a (C.sub.1 -C.sub.4)alkoxycarbonyl group,, and when R.sup.5 is a methyl group, R.sup.6 is a hydrogen atom, X represents a group represented by a formula CH or a nitrogen atom, Y represents a hydrogen or halogen atom, Z represents a trifluoromethyl, trifluoromethoxy or 1,1,2,2-tetrafluoroethoxy group and n is an integer of 0, 1 or 2 and its metal salt, ammonium salt and organic ammonium salt, its production and herbicides containing it as an active ingredient.

  一种由通式（I）表示的新型环己烷化合物，其中R.sup.1代表氢原子或（C.sub.1 -C.sub.6）烷基或（C.sub.1 -C.sub.4）烷氧甲基基团，R.sup.2代表（C.sub.1 -C.sub.12）烷基，（C.sub.3 -C.sub.6）烯基，（C.sub.3 -C.sub.6）炔基，（C.sub.3 -C.sub.6）环烷基甲基，卤代（C.sub.3 -C.sub.6）烯基，氰基（C.sub.1 -C.sub.4）烷基，（C.sub.1 -C.sub.4）烷氧甲基，（C.sub.1 -C.sub.4）烷硫甲基或苄基，R.sup.3代表氢原子或甲基基团，R.sup.4代表氢原子或甲基基团，R.sup.5是氢原子或甲基基团，当R.sup.5是氢原子时，R.sup.6是氢原子或（C.sub.1 -C.sub.4）烷氧羰基团，当R.sup.5是甲基基团时，R.sup.6是氢原子，X代表由CH式或氮原子表示的基团，Y代表氢或卤原子，Z代表三氟甲基，三氟甲氧基或1,1,2,2-四氟乙氧基基团，n为0、1或2的整数，以及其金属盐、铵盐和有机铵盐，其生产和含有其作为活性成分的除草剂。
• Cyclohexane herbicides
  申请人：SUMITOMO CHEMICAL COMPANY, LIMITED

  公开号：EP0253537B1

  公开（公告）日：1991-03-06
• Synthesis, and In vitro and In vivo muscarinic pharmacological properties of a series of 1,6-Dihydro-5-(4 H )-pyrimidinone oximes
  作者：Ralf Plate、Marc J.M. Plaum、Peter Pintar、Christan G. Jans、Thijs de Boer、Fred A. Dijcks、Ge Ruigt、John S. Andrews

  DOI：10.1016/s0968-0896(98)00074-1

  日期：1998.9

  A series of 1,6-dihydro-5-(4H)-pyrimidinone oxime derivatives I was synthesized (Scheme 1, Tables 1 and 2) and tested for muscarinic activity (Table 3) in receptor binding assays using [H-3]-oxotremorine-M (Oxo-M) and [H-3]-pirenzepine pirenzepine (Pz) as ligands. Potential muscarinic agonistic or antagonistic properties of the compounds were determined using binding studies that measured their potencies to inhibit the binding of Oxo-M and Pz. Preferential inhibition of Oxo-M binding was used as an indicator for potential muscarinic agonistic properties; this potential was confirmed in functional studies on isolated organs. The series produced a wide range of active compounds with differing degrees of selectivity in M-1, M-2, and M-3 functional models. Several compounds that have mixed agonist/antagonist profiles were able to reduce cholinergic-related cognitive impairments in models of mnemonic function. Substitutions (I, e.g. R-2 or R-3 = Me) at the 1,6-dihydro-5-(4H)pyrimidine ring disrupted binding and efficacy, whereas systematic variation of the oximes substituent R1 resulted in various degrees of potency and selectivity dependent on the nature of the substitution. (C) 1998 Elsevier Science Ltd. All rights reserved.
• Tadic, Dragana; Cassels, Bruce K.; Cave, Andre, Heterocycles, 1988, vol. 27, # 2, p. 407 - 422
  作者：Tadic, Dragana、Cassels, Bruce K.、Cave, Andre

  DOI：——

  日期：——
• Synthesis of Eupolauridine and Its Benzo-Annulated Derivative
  作者：Tat Hung Tong、Henry N.C. Wong

  DOI：10.1080/00397919208020497

  日期：1992.6

  The unique diazafluoranthene alkaloid eupolauridine (1) was synthesized by a three-step route utilizing as the initial step the thermal rearrangement of the oxime O-crotyl ether 12, which afforded onychine (2). Bracher pyridine synthesis procedure subsequently converted 2 into 1. On the other hand, Friedlander reaction was employed for the synthesis of 3, which is a benzo-annulated derivative of eupolauridine (1).