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2-[(1S,2S)-3-oxo-2-pent-2-enylcyclopentyl]acetic acid

中文名称
——
中文别名
——
英文名称
2-[(1S,2S)-3-oxo-2-pent-2-enylcyclopentyl]acetic acid
英文别名
——
2-[(1S,2S)-3-oxo-2-pent-2-enylcyclopentyl]acetic acid化学式
CAS
——
化学式
C12H18O3
mdl
——
分子量
210.273
InChiKey
ZNJFBWYDHIGLCU-UWVGGRQHSA-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):
    1.6
  • 重原子数:
    15
  • 可旋转键数:
    5
  • 环数:
    1.0
  • sp3杂化的碳原子比例:
    0.67
  • 拓扑面积:
    54.4
  • 氢给体数:
    1
  • 氢受体数:
    3

上下游信息

  • 上游原料
    中文名称 英文名称 CAS号 化学式 分子量

反应信息

  • 作为反应物:
    描述:
    2-[(1S,2S)-3-oxo-2-pent-2-enylcyclopentyl]acetic acid碳酸氢钠N,N'-二环己基碳二亚胺 作用下, 以 四氢呋喃 为溶剂, 反应 4.0h, 生成 (2-(3-oxo-2-(pent-2-en-1-yl)cyclopentyl)acetyl)-L-isoleucine
    参考文献:
    名称:
    Rational design and efficient synthesis of a fluorescent-labeled jasmonate
    摘要:
    A fluorescent-labeled jasmonate was rationally designed based on examination of the model of interaction between the jasmonate and its receptor. An efficient synthetic route has been developed for this molecule. The biological activity of this fluorescent probe was retained which was similar to that of the methyl jasmonate as examined by root growth inhibition bioassay. This fluorescent probe will greatly facilitate biological studies of jasmonates through fluorescent imaging. (C) 2012 Elsevier Ltd. All rights reserved.
    DOI:
    10.1016/j.tetlet.2012.06.006
  • 作为产物:
    描述:
    methyl jasmonate 在 lithium hydroxide monohydrate 、 盐酸 作用下, 以 四氢呋喃 为溶剂, 反应 1.0h, 生成 2-[(1S,2S)-3-oxo-2-pent-2-enylcyclopentyl]acetic acid
    参考文献:
    名称:
    Rational design and efficient synthesis of a fluorescent-labeled jasmonate
    摘要:
    A fluorescent-labeled jasmonate was rationally designed based on examination of the model of interaction between the jasmonate and its receptor. An efficient synthetic route has been developed for this molecule. The biological activity of this fluorescent probe was retained which was similar to that of the methyl jasmonate as examined by root growth inhibition bioassay. This fluorescent probe will greatly facilitate biological studies of jasmonates through fluorescent imaging. (C) 2012 Elsevier Ltd. All rights reserved.
    DOI:
    10.1016/j.tetlet.2012.06.006
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文献信息

  • SUBSTITUTED ARYL AND HETEROARYL CARBOXYLIC ACID HYDRAZIDES OR SALTS THEREOF AND USE THEREOF TO INCREASE STRESS TOLERANCE IN PLANTS
    申请人:BAYER CROPSCIENCE AKTIENGESELLSCHAFT
    公开号:US20180206495A1
    公开(公告)日:2018-07-26
    Substituted aryl- and heteroarylcarbonyl hydrazides The invention relates to substituted aryl- and heteroarylcarbonyl hydrazides of the general formula (I) or salts thereof where the radicals of the formula (I) are each as defined in the description for enhancing stress tolerance in plants to abiotic stress, and for enhancing plant growth and/or for increasing plant yield.
    该发明涉及通式(I)的取代芳基和杂芳基羰基肼或其盐,其中通式(I)的基团如描述中所定义,用于增强植物对非生物胁迫的耐受性,促进植物生长和/或增加植物产量。
  • [EN] AZOLINE COMPOUNDS<br/>[FR] COMPOSÉS AZOLINE
    申请人:BASF SE
    公开号:WO2015128358A1
    公开(公告)日:2015-09-03
    The present invention relates to azoline compounds of formula (I) wherein A, B1, B2, B3, G1, G2, X1, R1, R3a, R3b, Rg1 and Rg2 are as defined in the claims and the description. The compounds are useful for combating or controlling invertebrate pests, in particular arthropod pests and nematodes. The invention also relates to a method for controlling invertebrate pests by using these compounds and to plant propagation material and to an agricultural and a veterinary composition comprising said compounds.
    本发明涉及式(I)的噁唑啉化合物,其中A、B1、B2、B3、G1、G2、X1、R1、R3a、R3b、Rg1和Rg2如权利要求和描述中所定义。这些化合物对抗或控制无脊椎动物害虫,特别是节肢动物害虫和线虫方面具有用途。该发明还涉及一种利用这些化合物控制无脊椎动物害虫的方法,以及包括所述化合物的植物繁殖材料、农业和兽医组合物。
  • Molecules having pesticidal utility, and intermediates, compositions, and processes, related thereto
    申请人:Dow AgroSciences LLC
    公开号:US20180279612A1
    公开(公告)日:2018-10-04
    This disclosure relates to the field of molecules having pesticidal utility against pests in Phyla Arthropoda, Mollusca, and Nematoda, processes to produce such molecules, intermediates used in such processes, pesticidal compositions containing such molecules, and processes of using such pesticidal compositions against such pests. These pesticidal compositions may be used, for example, as acaricides, insecticides, miticides, molluscicides, and nematicides. This document discloses molecules having the following formula (“Formula One”).
    这份披露涉及具有对节肢动物门、软体动物门和线虫门害虫具有杀虫效用的分子领域,用于生产此类分子的过程,用于此类过程的中间体,含有此类分子的杀虫组合物,以及使用此类杀虫组合物对抗此类害虫的过程。这些杀虫组合物可以用作螨虫剂、杀虫剂、螨虫剂、软体动物杀虫剂和线虫杀虫剂。本文件披露了具有以下式(“式一”)的分子。
  • [EN] MOLECULES HAVING PESTICIDAL UTILITY, AND INTERMEDIATES, COMPOSITIONS, AND PROCESSES, RELATED THERETO<br/>[FR] MOLÉCULES PRÉSENTANT UNE UTILITÉ EN TANT QUE PESTICIDE, ET LEURS INTERMÉDIAIRES, COMPOSITIONS ET PROCÉDÉS
    申请人:DOW AGROSCIENCES LLC
    公开号:WO2017040194A1
    公开(公告)日:2017-03-09
    This disclosure relates to the field of molecules having pesticidal utility against pests in Phyla Arthropoda, Mollusca, and Nematoda, processes to produce such molecules, intermediates used in such processes, pesticidal compositions containing such molecules, and processes of using such pesticidal compositions aga inst such pests. These pesticidal compositions may be used, for example, as acaricides, insecticides, miticides, molluscicides, and nematicides. This document discloses molecules having the following formula ("Formula One").
    这份披露涉及具有对节肢动物门、软体动物门和线虫门害虫有用的分子领域,用于生产这种分子的过程,用于这种过程的中间体,含有这种分子的杀虫剂组合物,以及使用这种杀虫剂组合物对抗这些害虫的过程。这些杀虫剂组合物可以用作螨虫剂、杀虫剂、螨虫剂、软体动物杀虫剂和线虫杀虫剂。本文件披露了具有以下化学式(“化学式一”)的分子。
  • [EN] HERBICIDAL PROPYNYL-PHENYL COMPOUNDS<br/>[FR] COMPOSÉS PROPYNYLE-PHÉNYLE HERBICIDES
    申请人:SYNGENTA PARTICIPATIONS AG
    公开号:WO2015197468A1
    公开(公告)日:2015-12-30
    The present invention relates to a compound of formula (I) wherein: R1 is C1-C3alkoxy, C1-C2alkoxy-C1-C3alkoxy, C1-C2fluoroalkoxy, ethyl, n-propyl, n-butyl, cyclopropyl or ethynyl; R2 is hydrogen, ethyl, n-propyl, cyclopropyl, vinyl, ethynyl, C1-C3alkoxy, C1-C3fluoroalkyl, C1-C2fluoroalkoxy, C1-C2alkoxy-C1-C3alkoxy-, or C1fluoroalkoxy-C1-C3alkoxy-; provided that when R1 is ethyl, n-propyl, n-butyl, cyclopropyl or ethynyl, then R2 is hydrogen, ethyl, n-propyl, cyclopropyl, vinyl or ethynyl; and Y is O, S, S(O), S(O)2, N(C1-C2alkyl), N(C1-C2alkoxy), C(O), CR8R9 or -CR10R11CR12R13-; and and G, R3, R4, R5 and R6 are as defined herein; wherein the compound of formula (I) is optionally present as an agrochemically acceptable salt thereof. These compounds are suitable for use as herbicides. The invention therefore also relates to a method of controlling weeds, especially grassy monocotyledonous weeds, in crops of useful plants, comprising applying a compound of formula (I), or a herbicidal composition comprising such a compound, to the plants or to the locus thereof.
    本发明涉及一种具有以下结构的化合物(I):其中:R1为C1-C3烷氧基,C1-C2烷氧基-C1-C3烷氧基,C1-C2氟烷氧基,乙基,正丙基,正丁基,环丙基或乙炔基;R2为氢,乙基,正丙基,环丙基,乙烯基,乙炔基,C1-C3烷氧基,C1-C3氟烷基,C1-C2氟烷氧基,C1-C2烷氧基-C1-C3烷氧基,或C1氟烷氧基-C1-C3烷氧基-;但是当R1为乙基,正丙基,正丁基,环丙基或乙炔基时,R2为氢,乙基,正丙基,环丙基,乙烯基或乙炔基;Y为O,S,S(O),S(O)2,N(C1-C2烷基),N(C1-C2烷氧基),C(O),CR8R9或-CR10R11CR12R13-;以及G,R3,R4,R5和R6如本文所定义;其中化合物(I)可作为农药中可接受的盐存在。这些化合物适用于用作除草剂。因此,本发明还涉及一种控制杂草,特别是草本单子叶杂草,在有用植物作物中的方法,包括将化合物(I)或含有这种化合物的除草剂组合物施用于植物或其生长地点。
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