[1-[2-Di(pyrrol-1-yl)phosphanyloxy-5,6,7,8-tetrahydronaphthalen-1-yl]-5,6,7,8-tetrahydronaphthalen-2-yl]oxy-di(pyrrol-1-yl)phosphane

• 分子结构分类: 有机化合物 - 苯类化合物 - 四氢化萘
• 英文名称: [1-[2-Di(pyrrol-1-yl)phosphanyloxy-5,6,7,8-tetrahydronaphthalen-1-yl]-5,6,7,8-tetrahydronaphthalen-2-yl]oxy-di(pyrrol-1-yl)phosphane
• 英文别名: [1-[2-di(pyrrol-1-yl)phosphanyloxy-5,6,7,8-tetrahydronaphthalen-1-yl]-5,6,7,8-tetrahydronaphthalen-2-yl]oxy-di(pyrrol-1-yl)phosphane
• 化学式: C₃₆H₃₆N₄O₂P₂
• 分子量: 618.6
• InChiKey: PMKYNXBUZIFIHB-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  9
• 重原子数：
  44
• 可旋转键数：
  9
• 环数：
  8.0
• sp3杂化的碳原子比例：
  0.22
• 拓扑面积：
  38.2
• 氢给体数：
  0
• 氢受体数：
  2

文献信息

• Bidentate Ligands for Hydroformylation of Ethylene
  申请人：DOW TECHNOLOGY INVESTMENTS LLC

  公开号：US20150328628A1

  公开（公告）日：2015-11-19

  A process for the hydroformylation of ethylene, with a transition metal, e.g., rhodium, catalyst promoted with a bidentate ligand of Formula I, II or III in which each R 1 -R 24 are independently a hydrogen, a hydrocarbyl group, an aromatic ring, a heteroaromatic ring or a halogen atom, or a heterocarbyl group. X 1 is CH 2 or O, while X 2 is O or C(R 25 ) 2 , where each R 25 may be the same or different and is a hydrogen, a cycloaliphatic group, an aromatic ring, a heteroaromatic ring or a halogen atom, or a heterocarbyl group, wherein two R 25 groups may combine in a fused ring, and Y is a pyrrole group bound via the nitrogen atom to phosphorus, wherein each pyrrole group may bear multiple substituents selected from among the groups alkyl, alkoxy, acyl, carboxyl, carboxylate, cyano, —SO 3 H, sulfonate, amino, trifluoromethyl and halogen.

  一种用过渡金属（例如铑）催化剂促进的双齿配体（化学式I、II或III）的乙烯氢甲酰化过程，其中每个R1-R24独立地是氢、烃基团、芳香环、杂芳环或卤素原子，或者是杂烃基团。X1为CH2或O，而X2为O或C(R25)2，其中每个R25可能相同或不同，是氢、环烷基团、芳香环、杂芳环或卤素原子，或者是杂烃基团，其中两个R25基团可以结合成融合环，Y是通过氮原子与磷结合的吡咯基团，其中每个吡咯基团可以带有多个取代基，取代基可选择自烷基、烷氧基、酰基、羧基、羧酸盐、氰基、—SO3H、磺酸盐、氨基、三氟甲基和卤素等基团。
• Bidentate ligands for hydroformylation of ethylene
  申请人：Dow Technology Investments LLC

  公开号：EP2740535A1

  公开（公告）日：2014-06-11

  A process for the hydroformylation of ethylene, with a transition metal, e.g., rhodium, catalyst promoted with a bidentate ligand of Formula I, II or III in which each R1 -R24 are independently a hydrogen, a hydrocarbyl group, an aromatic ring, a heteroaromatic ring or a halogen atom, or a heterocarbyl group. X1 is CH2 or O, while X2 is O or C(R25)2, where each R25 may be the same or different and is a hydrogen, a cycloaliphatic group, an aromatic ring, a heteroaromatic ring or a halogen atom, or a heterocarbyl group, wherein two R25 groups may combine in a fused ring, and Y is a pyrrole group bound via the nitrogen atom to phosphorus, wherein each pyrrole group may bear multiple substituents selected from among the groups alkyl, alkoxy, acyl, carboxyl, carboxylate, cyano, -SO3H, sulfonate, amino, trifluoromethyl and halogen.

  一种用过渡金属（例如钌）催化剂促进的双齿配体（化学式I、II或III）的乙烯氢甲酰化过程，其中每个R1-R24独立地是氢、烃基团、芳香环、杂芳环或卤素原子，或者是杂烃基团。X1为CH2或O，而X2为O或C（R25）2，其中每个R25可能相同也可能不同，是氢、环脂肪基团、芳香环、杂芳环或卤素原子，或者是杂烃基团，其中两个R25基团可能结合成融合环，Y是通过氮原子与磷结合的吡咯基团，其中每个吡咯基团可能带有多个从烷基、烷氧基、酰基、羧基、羧酸盐、氰基、-SO3H、磺酸盐、氨基、三氟甲基和卤素中选择的取代基。
• [EN] COMPOSITION HAVING A MUGUET ODOR<br/>[FR] COMPOSITION AYANT UNE ODEUR DE MUGUET
  申请人：FIRMENICH & CIE

  公开号：WO2018134221A1

  公开（公告）日：2018-07-26

  The present invention relates to a composition of matter comprising a) at least one compound of formula (I) in the form of any one of its isomers or a mixture thereof; wherein R1 represents a hydrogen atom or a C1-2 alkyl group; and R represents a group of formula – CH2C(Me)2OH; said R being, relative to position 1, a meta, a para substituent of the aromatic ring or a mixture thereof; and b) at least one compound of formula (II) in the form of any one of its isomers or a mixture thereof; wherein R1 and R have the same meaning as defined in formula (I); said R being, relative to position 1, an ortho, a meta, a para substituent of the aromatic ring or a mixture thereof; their uses as perfuming ingredients as well as the composition and consumer product including such a composition of matter and the process to prepare it.

  本发明涉及一种物质组成，包括a) 公式(I)的至少一种化合物，其为其任何异构体或其混合物；其中R1代表氢原子或C1-2烷基基团；R代表公式-CH2C（Me）2OH的基团；相对于位置1，其为芳香环的间位、对位取代基团或其混合物；b) 公式(II)的至少一种化合物，其为其任何异构体或其混合物；其中R1和R具有与公式(I)中定义的相同含义；相对于位置1，其为芳香环的邻位、间位、对位取代基团或其混合物；它们作为香料成分的用途，以及包括这种物质组成的组合物和消费品以及其制备过程。
• Composition having a muguet odor
  申请人：FIRMENICH SA

  公开号：US10597605B2

  公开（公告）日：2020-03-24

  A composition of matter comprising a) at least one compound of formula in the form of any one of its isomers or a mixture thereof; wherein R1 represents a hydrogen atom or a C1-2 alkyl group; and R represents a group of formula —CH2C(Me)2OH; with R being, relative to position 1, a meta, a para substituent of the aromatic ring or a mixture thereof; and b) at least one compound of formula in the form of any one of its isomers or a mixture thereof; wherein R1 and R have the same meaning as defined in formula (I); their uses as perfuming ingredients as well as perfuming composition and consumer products including such a composition of matter and a process to prepare the composition.

  一种物质组合物，包括 a) 至少一种式化合物 其中 R1 代表氢原子或 C1-2 烷基；R 代表式-CH2C(Me)2OH 的基团；相对于位置 1，R 是芳香环的元、对位基团或它们的混合物；和 b) 至少一种式化合物 其中 R1 和 R 的含义与式（I）中所定义的相同； 它们作为香料成分的用途，以及包括这种物质组合物和制备该组合物的工艺在内的香水组合物和消费品。
• COMPOSITION HAVING A MUGUET ODOR
  申请人：Firmenich SA

  公开号：EP3571274B1

  公开（公告）日：2020-11-25