4-amino-4'-ferrocenylazobenzene | 216986-73-1

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 偶氮苯
• 英文名称: 4-amino-4'-ferrocenylazobenzene
• 英文别名: 4-amino-4'-ferocenylazobenzene；cyclopenta-1,3-diene;4-[(4-cyclopenta-1,3-dien-1-ylphenyl)diazenyl]aniline;iron(2+)
• CAS: 216986-73-1
• 化学式: C₂₂H₁₉FeN₃
• 分子量: 381.26
• InChiKey: AUWWVFRPWWTALU-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.47
• 重原子数：
  26
• 可旋转键数：
  3
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  50.7
• 氢给体数：
  1
• 氢受体数：
  5

反应信息

• 作为反应物：
  描述：

  4-amino-4'-ferrocenylazobenzene 、 在 triethylamine 作用下， 以 甲苯 为溶剂， 以79%的产率得到
  参考文献：
  名称：

  Second-Order Nonlinear Performance of Poly(methyl methacrylate) Films with Dispersed Donor−Acceptor Organobimetallic Compounds

  摘要：

  New organobimetallic Mo/Fe compounds of the type [Mo(Tp(An))(NO)(Cl)(Y-pi-bridge)(Fc)] {Tp(An) = hydrotris-(3-p-methoxyphenylpyrazol-1-yl)borate; Fc = (eta(5)-C5H4)Fe(eta(5)-C5H5); Y = NH (1), O (5), bridge = C6H4; Y NH, bridge C6H3R-N=N-C6H3R' [R = R' H (2); R = CH3, R' = H (3); R = R' = CH3 (4); Y = NH, bridge = C6H4-CH=CH-C6H4 (6)} have been synthesized and characterized. The second-harmonic generation yield of corona-poled spin-coated films of poly(methyl methacrylate) containing these compounds has been investigated. The three nonzero components, chi(31)((2)), chi(15)((2)), and chi(33)((2)), of the susceptibility tensor have been measured. chi 31(2) is the highest component at different with linear (one-dimensional) molecules where chi(33)((2)) = 3 chi(31)((2)) Moreover, Kleinman symmetry (chi(31)((2)) = chi(15)((2)) is not obeyed. These results have been discussed on the basis of a low-lying charge-transfer optical transition that has a perpendicular component to the permanent dipole moment. From the measured chi((2)) components, the molecular hyperpolarizabilities beta(33), beta(15), and beta(31) have been estimated under the assumption of thermal equilibrium under the poling field. On the ether hand, the role of diverse bridging structures on the susceptibilities, including different lengths (diarylazoamide vs anilide), as well as methyl substituents and linking (C-C vs N=N) groups, has been evaluated. Moreover, the acceptor [Mo(Tp(An))(NO)(Cl)(Y)] and nitro groups have been compared in compounds having the same ferrocenyl donor group and polarizable bridging system. chi(31)((2)) susceptibilities are significant in most cases, and values as high as 6.6 x 10(-9) esu have been obtained for the 4-nitro-4'-ferrocenylstilbene compound.

  DOI：

  10.1021/jp982764v
• 作为产物：
  描述：

  sodiumsulfide nonahydrate 、 4-ferrocenyl-4'-nitroazobenzene 以 乙醇 为溶剂， 以95%的产率得到4-amino-4'-ferrocenylazobenzene
  参考文献：
  名称：

  含钼或钨单亚硝酰基氧化还原中心的非线性光学材料：二芳族偶氮衍生物

  摘要：

  已制备以下化合物：[M（NO）L（X）n {EC 6 H 3（R-3）[N NC 6 H 3（R'-3）（R''-4）-4]} 2 – n ] [L =三（3,5-二甲基吡唑基）氢硼酸盐；R“=（η 5 -C 5 H ^ 4）的Fe（η 5 -C 5 H ^ 5）中，E = O，R = R'= H，M =钼，X = Cl或I，ñ = 0或1; E ＝ NH，R ＝ R′＝ H，n＝ 1，M ＝ Mo或W，X ＝ Cl。E ＝ NH，R ＝ Me，R′＝ H，n＝ 1，M ＝ Mo，X ＝ F，Cl，Br，I或OC 6 H 11；E ＝ NH，R ＝ Me，R ＝ H，n＝ 1，M ＝ Mo，X ＝ F，Cl，Br，I或OC 6 H 11。M = W，X = Cl；E = NH，R = R′= Me，n= 1，M = Mo，X = Cl或I；M = W，X = Cl；R” ＝ NMe 2，E

  DOI：

  10.1039/dt9940003427

文献信息

• A new route to mixed oxo/arylimido complexes of molybdenum(VI) with a tris(pyrazolyl)borate co-ligand: syntheses, spectroscopic properties and ligand-centred redox activity
  作者：Siu-Ming Lee、Ralph Kowallick、Massimo Marcaccio、Jon A. McCleverty、Michael D. Ward

  DOI：10.1039/a804496a

  日期：——

  [Cl(O)(TpMe,Me)Mo}2 (NC6H4N)] 4. Reaction of various aminoferrocene derivatives Fc–X–NH2 with [Mo(TpMe,Me)(O)Cl2] afforded the dinuclear ferrocenyl–molybdenum complexes [Mo(O)(TpMe,Me)Cl(NXFc)] 5 (X = nothing), 6 (X = 1,4-C6H4), 7 (X = C6H4CHCHC6H4 with all para substitution) and 8 (X = C6H4NNC6H4 with all para substitution). Reaction of [Mo(TpMe,Me)(O)Cl2] with mixed amine–phenol ligands HO–X–NH2 afforded

  氧钼（V）前体[Mo（Tp Me，Me）（O）Cl 2 ] [Tp Me，Me  氢化三（3,5-二甲基吡唑-1-基）硼酸酯]与芳胺RNH 2的反应Et 3 N和空气的存在下，提供了氧代（亚氨基）钼（VI）配合物[Mo（O）（Tp Me，Me）Cl（NR）] 1（R = 4-甲苯基），2（R = C 6 H 4 NMe 2 -4）；这是获得这些稀有化合物的新途径。1,4-二氨基苯的使用，得到单核配合物3（R = C 6 H ^ 4 NH 2 -4）除了双核配合物[CL（O）（TPMe，Me）Mo} 2（NC 6 H 4 N）] 4.各种氨基二茂铁衍生物Fc–X–NH 2与[Mo（Tp Me，Me）（O）Cl 2 ]的反应得到双核二茂铁基–钼配合物[Mo（O）（Tp Me，Me）Cl（NXFc）] 5（X =无），6（X = 1,4-C 6 H 4），7（X = C 6 H 4 CHCHC