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4,6-二苯氧基嘧啶 | 156592-09-5

中文名称
4,6-二苯氧基嘧啶
中文别名
——
英文名称
4,6-diphenoxypyrimidine
英文别名
——
4,6-二苯氧基嘧啶化学式
CAS
156592-09-5
化学式
C16H12N2O2
mdl
——
分子量
264.283
InChiKey
VNUQMXLZNZGGAC-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

计算性质

  • 辛醇/水分配系数(LogP):
    3.9
  • 重原子数:
    20
  • 可旋转键数:
    4
  • 环数:
    3.0
  • sp3杂化的碳原子比例:
    0.0
  • 拓扑面积:
    44.2
  • 氢给体数:
    0
  • 氢受体数:
    4

反应信息

  • 作为反应物:
    描述:
    palladium diacetate 、 4,6-二苯氧基嘧啶 为溶剂, 生成
    参考文献:
    名称:
    Cyclometallated compounds. XIII. Cyclopalladation of 2-phenoxypyridine and structurally-related compounds
    摘要:
    2-Phenoxypyridine and 2-phenylsulfanylpyridine are cyclopalladated readily by palladium acetate to give six-membered metallocycles. Extension to the three isomeric bis(2-pyridyloxy)benzenes leads to a new series of doubly-cyclopalladated compounds. In contrast, 3-6-diphenoxypyridazine and 4-6-diphenoxypyrimidine only undergo monopalladation, whilst their sulfur analogues are resistant to cyclopalladation. All cyclometallated compounds are converted to their acetylacetonate derivatives and the X-ray crystal structure of one of these is described. (C) 1999 Elsevier Science S.A. All rights reserved.
    DOI:
    10.1016/s0022-328x(98)01203-0
  • 作为产物:
    描述:
    4,6-二氯嘧啶苯酚potassium carbonate 作用下, 反应 1.0h, 以89%的产率得到4,6-二苯氧基嘧啶
    参考文献:
    名称:
    Cyclometallated compounds. XIII. Cyclopalladation of 2-phenoxypyridine and structurally-related compounds
    摘要:
    2-Phenoxypyridine and 2-phenylsulfanylpyridine are cyclopalladated readily by palladium acetate to give six-membered metallocycles. Extension to the three isomeric bis(2-pyridyloxy)benzenes leads to a new series of doubly-cyclopalladated compounds. In contrast, 3-6-diphenoxypyridazine and 4-6-diphenoxypyrimidine only undergo monopalladation, whilst their sulfur analogues are resistant to cyclopalladation. All cyclometallated compounds are converted to their acetylacetonate derivatives and the X-ray crystal structure of one of these is described. (C) 1999 Elsevier Science S.A. All rights reserved.
    DOI:
    10.1016/s0022-328x(98)01203-0
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文献信息

  • 10.1039/d4ra00001c
    作者:Bhuyan, Amar Jyoti、Nath, Partha Pratim、Bharali, Sourav Jyoti、Saikia, Lakhinath
    DOI:10.1039/d4ra00001c
    日期:——
    modification, the authors discovered a new polymeric Cu-complex that contains μ3-CO3 bridges. The polymeric linear structure of the complex was established using single crystal X-ray analysis. FT-IR, UV-vis and DSC studies were also performed on the polymeric complex. This novel polymeric Cu-complex was found to efficiently catalyse C–O/C–S cross coupling reactions between chloropyrimidines and phenols/thiophenols
    该手稿报道了新型聚合物铜络合物 ([Cu 3 (DMAP) 8 (μ 3 -CO 3 ) 2 ]I 2 ) n · x H 2 O 的合成和表征及其在 C-O 和 C 中的成功应用-S 交叉偶联反应用于合成具有生物学意义的重要苯氧基嘧啶和芳硫嘧啶支架。尝试采用Roy等人报道的方法合成[Cu(DMAP) 4 I]I。经过轻微修改,作者发现了一种包含 μ 3 -CO 3桥的新聚合铜络合物。使用单晶 X 射线分析建立了复合物的聚合线性结构。还对聚合物复合物进行了 FT-IR、UV-vis 和 DSC 研究。这种新型聚合铜配合物被发现可以在短时间内有效催化水性介质中氯嘧啶和苯酚/硫酚之间的C-O/C-S交叉偶联反应,产生相应的苯氧基嘧啶和芳硫嘧啶。使用该方案,成功合成了 22 个苯氧基嘧啶和 6 个芳硫嘧啶。使用1 H 和13 C NMR 光谱和 HRMS 分析对合成的新型化合物进行了很好的表征,并使用
  • [EN] PHENOXYPYRIMIDINE INSECTICIDES AND ACARICIDES<br/>[FR] PHENOXYPYRIMIDINES INSECTICIDES ET ACARICIDES
    申请人:DU PONT
    公开号:WO2000049001A2
    公开(公告)日:2000-08-24
    Compounds of Formula (I), and their N-oxides and agriculturally suitable salts, are disclosed which are useful as arthropodicides wherein Q1 is O, S, NR?17, OCR18R19, or NR17CR18R19¿; wherein when Q?1 is OCR18R19 or NR17CR18R19¿, then Q1 is attached to the pyrimidine through the O or N atom respectively; Q2 is S, CR?3R4, OCR18R19, SCR18R19 or NR17CR18R19¿; wherein when Q?2 is OCR18R19, SCR18R19 or NR17CR18R19 then Q2¿ is attached to the pyrimidine through the O, S or N atom respectively; R?1 and R2¿ are each independently H, C¿1?-C4 alkyl, halogen, NR?7R8, C¿1-C4 alkoxy, C1-C4 haloalkyl, C1-C4 alkylthio or nitro; each R5 is independently H, halogen, C¿1?-C4 alkyl, C1-C4 haloalkoxy, C1-C4 haloalkyl, C1-C4 alkoxy, SF5, S(O)nR?9¿, cyano or CO¿2R?11; each R6 and each R22 is independently H, halogen, cyano, C¿1?-C4 alkyl, C1-C4 haloalkyl, C1-C4 haloalkoxy, C1-C4 alkoxy, NR?17¿ or S(O)¿nR?9; p is 0-4; and J, R?3, R4R7, R8, R9, R11, R17, R18, R19¿ and n are as defined in the disclosure. Also disclosed are compositions containing the compounds of Formula (I) and a method for controlling arthropods which involves contacting the arthropods or their environment with an effective amount of a compound of Formula (I).
  • Cyclometallated compounds. XIII. Cyclopalladation of 2-phenoxypyridine and structurally-related compounds
    作者:Duncan J de Geest、Brendan J O’Keefe、Peter J Steel
    DOI:10.1016/s0022-328x(98)01203-0
    日期:1999.5
    2-Phenoxypyridine and 2-phenylsulfanylpyridine are cyclopalladated readily by palladium acetate to give six-membered metallocycles. Extension to the three isomeric bis(2-pyridyloxy)benzenes leads to a new series of doubly-cyclopalladated compounds. In contrast, 3-6-diphenoxypyridazine and 4-6-diphenoxypyrimidine only undergo monopalladation, whilst their sulfur analogues are resistant to cyclopalladation. All cyclometallated compounds are converted to their acetylacetonate derivatives and the X-ray crystal structure of one of these is described. (C) 1999 Elsevier Science S.A. All rights reserved.
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