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十一碳-10-烯基丙酸酯 | 72928-24-6

中文名称
十一碳-10-烯基丙酸酯
中文别名
——
英文名称
undec-10-en-1-yl propanoate
英文别名
undec-10-enyl propionate;Undec-10-enyl propanoate
十一碳-10-烯基丙酸酯化学式
CAS
72928-24-6
化学式
C14H26O2
mdl
——
分子量
226.359
InChiKey
MVNIQZNNNMCYJX-UHFFFAOYSA-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

物化性质

  • LogP:
    5.472 (est)

计算性质

  • 辛醇/水分配系数(LogP):
    5.1
  • 重原子数:
    16
  • 可旋转键数:
    12
  • 环数:
    0.0
  • sp3杂化的碳原子比例:
    0.79
  • 拓扑面积:
    26.3
  • 氢给体数:
    0
  • 氢受体数:
    2

SDS

SDS:b248157c69c750a76472a753d5baef4c
查看

反应信息

  • 作为反应物:
    描述:
    十一碳-10-烯基丙酸酯cis-{molybdenum(0)(carbonyl)4(P(phenyl)3)2}对甲苯磺酸 作用下, 以 四氢呋喃 为溶剂, 反应 0.5h, 生成 (E)-undec-9-en-1-yl propionate 、 (Z)-undec-9-en-1-yl propionate
    参考文献:
    名称:
    稳定的钼(0)络合物催化末端烯烃选择性异构化为(Z)-2-烯烃
    摘要:
    使用顺式-Mo(CO)4(PPh 3)2预催化剂观察到末端烯烃异构化为内部烯烃的位置和立体化学选择性。甲p -甲苯磺酸(TsOH)助催化剂为催化剂活性是必需的。各种官能化的末端烯烃已被转化为相应的2-烯烃,在高转化率下通常有利于Z异构体,其选择性高达8:1 Z:E。通过31 P NMR对催化剂引发机理的研究表明,顺式-Mo(CO)4(PPh 3)2在高温下与TsOH反应生成磷化氢键合的Mo氢化物(MoH)物种。催化可通过将末端烯烃的2,1-插入MoH基团和立体选择性β-氢化物消除以产生(Z)-2-烯烃来进行。
    DOI:
    10.1021/acs.organomet.7b00914
  • 作为产物:
    描述:
    10-十一烯-1-醇丙酰氯吡啶 作用下, 以 二氯甲烷 为溶剂, 反应 1.5h, 以62%的产率得到十一碳-10-烯基丙酸酯
    参考文献:
    名称:
    稳定的钼(0)络合物催化末端烯烃选择性异构化为(Z)-2-烯烃
    摘要:
    使用顺式-Mo(CO)4(PPh 3)2预催化剂观察到末端烯烃异构化为内部烯烃的位置和立体化学选择性。甲p -甲苯磺酸(TsOH)助催化剂为催化剂活性是必需的。各种官能化的末端烯烃已被转化为相应的2-烯烃,在高转化率下通常有利于Z异构体,其选择性高达8:1 Z:E。通过31 P NMR对催化剂引发机理的研究表明,顺式-Mo(CO)4(PPh 3)2在高温下与TsOH反应生成磷化氢键合的Mo氢化物(MoH)物种。催化可通过将末端烯烃的2,1-插入MoH基团和立体选择性β-氢化物消除以产生(Z)-2-烯烃来进行。
    DOI:
    10.1021/acs.organomet.7b00914
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文献信息

  • Halogen substituted metallocene compounds for olefin polymerization
    申请人:Voskoboynikov Z. Alexander
    公开号:US20070135594A1
    公开(公告)日:2007-06-14
    A metallocene compound is represented by the formula (1): AMX n-1 wherein M is a transition metal atom having a coordination number of n selected from Group 3, 4, 5 or 6 of the Periodic Table of Elements, or a lanthanide metal atom, or actinide metal atom; A is a substituted monocyclic or polycyclic arenyl ligand pi-bonded to M, wherein said arenyl ligand includes at least one halogen substituent directly bonded to any sp 2 carbon atom at a bondable ring position of the ligand; and the or each X is a univalent anionic ligand, or two X are joined and bound to the metal atom to form a metallocycle ring, or two X are joined to form a chelating ligand, a diene ligand, or an alkylidene ligand.
    一种金属烯化合物可以用公式(1)表示: AMX n-1 其中,M是具有配位数n的过渡金属原子,选自元素周期表第3、4、5或6族,或为镧系金属原子,或锕系金属原子;A是与M以π键结合的取代的单环或多元环芳基配体,其中所述芳基配体包括至少一个直接键合到配体的可键合环位上的任意sp2碳原子上的卤素取代基;而X是单价阴离子配体,或者两个X连接并与金属原子结合形成一个金属环烯环,或者两个X连接形成一个螯合配体、二烯配体或烷基亚烯配体。
  • [EN] TRANSITION METAL COMPOUNDS FOR OLEFIN POLYMERIZATION AND OLIGOMERIZATION<br/>[FR] COMPOSES METALLIQUES DE TRANSITION POUR LA POLYMERISATION D'OLEFINES ET L'OLIGOMERISATION
    申请人:EXXONMOBIL CHEM PATENTS INC
    公开号:WO2005118605A1
    公开(公告)日:2005-12-15
    This invention relates to new transition metal catalyst compounds represented by the formula (I): where: M and M' are, independently, a group 8, 9, 10 or 11 transition metal, preferably Ni, Co, Pd, Cu or Fe; each R group is, independently, is, hydrogen, or a hydrocarbyl, substituted hydrocarbyl, halocarbyl, substituted halocarbyl, silylcarbyl, substituted silylcarbyl, germylcarbyl, or substituted germylcarbyl substituents, and optionally, adjacent R groups may join together to form a substituted or unsubstituted, saturated, partially unsaturated, or aromatic cyclic or polycyclic substituent; R' is hydrogen, or a hydrocarbyl, substituted hydrocarbyl, halocarbyl, substituted halocarbyl, silylcarbyl, substituted silylcarbyl, germylcarbyl, or substituted germylcarbyl substituents, and optionally, adjacent R groups may join together with R' to form a substituted or unsubstituted, saturated, partially unsaturated, or aromatic cyclic or polycyclic substituent; each X group is, independently, is, hydrogen, a halogen, or a hydrocarbyl, substituted hydrocarbyl, halocarbyl, substituted halocarbyl, silylcarbyl, substituted sililcarbyl, germylcarbyl, or substituted germylcarbyl substituents, and optionally, adjacent X groups may join together to form a substituted or unsubstituted, saturated, partially unsaturated, or aromatic cyclic or polycyclic substituent; m and m’ are, independently, 0, 1, 2, or 3; z and z’ are, independently, 0, 1, 2, or 3; N is nitrogen; Q is hydrogen, or a hydrocarbyl, substituted hydrocarbyl, halocarbyl, substituted halocarbyl, silylcarbyl, substituted silylcarbyl, germylcarbyl, or substituted germylcarbyl substituents; Q’ is hydrogen, or a hydrocarbyl, substituted hydrocarbyl, halocarbyl, substituted halocarbyl, silylcarbyl, substituted silylcarbyl, germylcarbyl or substituted germylcarbyl substituents; and L is a hydrocarbyl, substituted hydrocarbyl, halocarbyl, substituted halocarbyl, silylcarbyl, substituted silylcarbyl, germylcarbyl, or substituted germylcarbyl substituent.
    这项发明涉及由式(I)表示的新过渡金属催化剂化合物,其中:M和M'分别是8、9、10或11族过渡金属,优选为Ni、Co、Pd、Cu或Fe;每个R基分别是氢,或烃基,取代烃基,卤代烃基,取代卤代烃基,硅烃基,取代硅烃基,锗烃基,或取代锗烃基取代基,且可选地,相邻的R基可以结合在一起形成取代或未取代的饱和、部分不饱和或芳香环或多环取代基;R'是氢,或烃基,取代烃基,卤代烃基,取代卤代烃基,硅烃基,取代硅烃基,锗烃基,或取代锗烃基取代基,且可选地,相邻的R基可以与R'结合在一起形成取代或未取代的饱和、部分不饱和或芳香环或多环取代基;每个X基分别是氢,卤素,或烃基,取代烃基,卤代烃基,取代卤代烃基,硅烃基,取代硅烃基,锗烃基,或取代锗烃基取代基,且可选地,相邻的X基可以结合在一起形成取代或未取代的饱和、部分不饱和或芳香环或多环取代基;m和m'分别为0、1、2或3;z和z'分别为0、1、2或3;N为氮;Q为氢,或烃基,取代烃基,卤代烃基,取代卤代烃基,硅烃基,取代硅烃基,锗烃基,或取代锗烃基取代基;Q'为氢,或烃基,取代烃基,卤代烃基,取代卤代烃基,硅烃基,取代硅烃基,锗烃基,或取代锗烃基取代基;L为烃基,取代烃基,卤代烃基,取代卤代烃基,硅烃基,取代硅烃基,锗烃基,或取代锗烃基取代基。
  • Photoacylation of Alcohols in Neutral Medium
    作者:Jean-Luc Débieux、Anne Cosandey、Céline Helgen、Christian G. Bochet
    DOI:10.1002/ejoc.200600790
    日期:2007.5
    We report here conditions which allow the photoacylation of primary, secondary and tertiary alcohols with N-acetyl-5,7-dinitroindoline under exceptionally mild conditions, at wavelengths harmless to most functional groups, including otherwise photosensitive ones. (© Wiley-VCH Verlag GmbH & Co. KGaA, 69451 Weinheim, Germany, 2007)
    我们在这里报告了允许伯醇、仲醇和叔醇与 N-乙酰基-5,7-二硝基二氢吲哚在异常温和的条件下,在对大多数官能团无害的波长下光酰化的条件,包括其他光敏的。(© Wiley-VCH Verlag GmbH & Co. KGaA, 69451 Weinheim, Germany, 2007)
  • Heteroatom bridged metallocene compounds for olefin polymerization
    申请人:Voskoboynikov Z. Alexander
    公开号:US20070135597A1
    公开(公告)日:2007-06-14
    This invention relates to a transition metal compound represented by the formula: wherein M is a group 3, 4, 5 or 6 transition metal atom, or a lanthanide metal atom, or actinide metal atom; E is: 1) a substituted or unsubstituted indenyl ligand that is bonded to Y through the four, five, six or seven position of the indenyl ring, or 2) a substituted or unsubstituted heteroindenyl ligand that is bonded to Y through the four, five or six position of the heteroindenyl ring, provided that the bonding position is not the same as the position of the ring heteroatom, or 3) a substituted or unsubstituted fluorenyl ligand that is bonded to Y through the one, two, three, four, five, six, seven or eight position of the fluorenyl ring, or 4) a substituted or unsubstituted heterofluorenyl ligand that is bonded to Y through the one, two, three, four, five or six position of the heteroindenyl ring, provided that the bonding position is not the same as the position of the ring heteroatom; A is a substituted or unsubstituted cyclopentadienyl ligand, a substituted or unsubstituted heterocyclopentadienyl ligand, a substituted or unsubstituted indenyl ligand, a substituted or unsubstituted heteroindenyl ligand, a substituted or unsubstituted fluorenyl ligand, a substituted or unsubstituted heterofluorenyl ligand, or other mono-anionic ligand; Y is a Group 15 or 16 bridging heteroatom substituent that is bonded via the heteroatom to E and A; and X are, independently, univalent anionic ligands, or both X are joined and bound to the metal atom to form a metallocycle ring, or both X join to form a chelating ligand, a diene ligand, or an alkylidene ligand. This invention further relates to catalyst systems comprising the above transiotioon metal compounds, activators and optional supports and their use to polymerize or oligomerize olefins.
    本发明涉及一种过渡金属化合物,其表示为以下公式:其中M是3、4、5或6族过渡金属原子,或镧系金属原子,或锕系金属原子;E是:1)与Y通过茚环的四、五、六或七位置结合的取代或未取代的茚基配体,或2)与Y通过杂环茚环的四、五或六位置结合的取代或未取代的杂环茚基配体,前提是结合位置与环杂原子的位置不同,或3)与Y通过芴环的一、二、三、四、五、六、七或八位置结合的取代或未取代的芴基配体,或4)与Y通过杂芴环的一、二、三、四、五或六位置结合的取代或未取代的杂芴基配体,前提是结合位置与环杂原子的位置不同;A是取代或未取代的环戊二烯基配体,取代或未取代的杂环戊二烯基配体,取代或未取代的茚基配体,取代或未取代的杂环茚基配体,取代或未取代的芴基配体,取代或未取代的杂芴基配体,或其他单阴离子配体;Y是通过杂原子与E和A结合的15族或16族桥接杂原子取代基;X是独立的一价阴离子配体,或两个X结合并与金属原子结合形成金属环,或两个X结合形成螯合配体、二烯基配体或烷基亚基配体。本发明还涉及包含上述过渡金属化合物、活化剂和可选支撑物的催化剂系统及其用于聚合或寡聚烯烃的用途。
  • Halogen substituted heteroatom-containing metallocene compounds for olefin polymerization
    申请人:Voskoboynikov Z. Alexander
    公开号:US20070135623A1
    公开(公告)日:2007-06-14
    Halogen substituted metallocene compounds are described and comprise one or more monocyclic or polycyclic ligands that are pi-bonded to the metal atom and include at least one halogen substituent directly bonded to an sp 2 carbon atom at a bondable ring position of the ligand, wherein the or at least one ligand has one or more ring heteroatoms in its cyclic structure. When combined with a suitable activator, these compounds show activity in the polymerization of olefins, such as ethylene and propylene.
    描述了卤代取代的茂金属化合物,包括一个或多个与金属原子π键结合的单环或多环配体,并且至少包括一个卤素取代基直接键合到配体的可键合环位置上的sp2碳原子,其中该配体或至少一个配体在其环状结构中具有一个或多个环异原子。与适当的活化剂结合时,这些化合物在烯烃聚合反应中显示出活性,例如乙烯和丙烯。
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