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[iron(κN,N'-neoPeNCH(2-pyridyl))2(methylacrilate)] | 1429328-83-5

中文名称
——
中文别名
——
英文名称
[iron(κN,N'-neoPeNCH(2-pyridyl))2(methylacrilate)]
英文别名
——
[iron(κN,N'-neoPeNCH(2-pyridyl))2(methylacrilate)]化学式
CAS
1429328-83-5
化学式
C26H38FeN4O2
mdl
——
分子量
494.46
InChiKey
MCQNWOTXJOQKBB-PHLYURFASA-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):
    None
  • 重原子数:
    None
  • 可旋转键数:
    None
  • 环数:
    None
  • sp3杂化的碳原子比例:
    None
  • 拓扑面积:
    None
  • 氢给体数:
    None
  • 氢受体数:
    None

反应信息

  • 作为产物:
    描述:
    NC5H4-2-C(H)=N(neo-Pent)丙烯酸甲酯(MA) 、 iron(II) chloride 在 sodium amalgam 作用下, 以 四氢呋喃 为溶剂, 反应 12.0h, 以15 mg的产率得到[iron(κN,N'-neoPeNCH(2-pyridyl))2(methylacrilate)]
    参考文献:
    名称:
    Syntheses and characterizations of α-iminopyridine compounds (alkylNCHpy)2Fe(L/Xn), and an assessment of redox non-innocence
    摘要:
    Treatment of cis-(Me3P)(4)FeMe2 with two equiv (neo)PeN=CH(2-py) afforded {kappa-N,N'-(neo)PeN=CH(2-pyridy1))(2)FeMe2 (2-P). Reductions of FeCl2 with Na/Hg in the presence of (neo)PeN=CH(2-pyridyl) or (neo)HexN=CH(2-pyridyl) and L (H2C=CHCO2Me, PhCCPh, PMe3) gave tentative evidence of [kappa-N,N'-(neo)PeN=CH(2-pyridy1)}(2)Fe(H2C=CHCO2Me) (2-P), but (x-N,N'-(neo)PeN=CH(2-pyridyI)}(2)Fe(PhCCPh) (5-P), (kappa-N,N'-neoHexN=CH(2-pyridy1)}(2)Fe(PhCCPh) (5-H), and {kappa-N,N'-(neo)HexN=CH(2-pyridy1))(2-)Fe(PMe)}(2-) (6-H) were all isolated in good yield. Phosphine complex 6-H could be alkylated with CH3I or CH3OTf to afford {kappa-N,N'-(neo)HexN=CH(2-pyridyl)}(2-)Fe(PMe3)Me]I-+(-) (7-H-I) or {kappa-N,N'-(neo)HexN=CH(2-pyridyl)}(2-)Fe(PMe3)Me]I-+(-) OTf- (7-H-OTf) center dot [{kappa-N,N'-RN=CH(2-pyridyl)}(3-)Fe][OTf](2) (R = (neo)Pe, 8-P-OTf; (neo-)Hex, 8-H-OTf) omplexes were also prepared from Fe(OTO)(2) in order to identify potential byproducts in certain reactions. Compounds 2-P and 7-H-0Tf were tested for ethylene oligomerization activity, to no avail. Complexes 2-P, 5-H, 6-H, and 7-H-OTf were structurally characterized and evaluated by Mossbauer spectroscopy, and 5-H was shown to possess a redox non-innocent alkyne ligand, while the alpha-alkyliminopyridine ligands of 6-H were classified as radical anions, rendering all compounds describable as Fe(ll). (C) 2012 Elsevier Ltd. All rights reserved.
    DOI:
    10.1016/j.poly.2012.08.060
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