2-[4-(2-hydroxy-2-methyl-propanoyl)phenoxy]ethyl 2-oxo-2-phenyl-acetate | 1599461-96-7

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 2-[4-(2-hydroxy-2-methyl-propanoyl)phenoxy]ethyl 2-oxo-2-phenyl-acetate
• 英文别名: 2-[4-(2-Hydroxy-2-methyl-propanoyl)phenoxy]ethyl 2-oxo-2-phenyl-acetate；2-[4-(2-hydroxy-2-methylpropanoyl)phenoxy]ethyl 2-oxo-2-phenylacetate
• CAS: 1599461-96-7
• 化学式: C₂₀H₂₀O₆
• 分子量: 356.375
• InChiKey: LEMNVMBUCIXZIK-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.9
• 重原子数：
  26
• 可旋转键数：
  9
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.25
• 拓扑面积：
  89.9
• 氢给体数：
  1
• 氢受体数：
  6

反应信息

• 作为产物：
  描述：

  氧代(苯基)乙酰氯 、 2-羟基-4'-(2-羟乙氧基)-2-甲基苯丙酮 在 吡啶 、 4-二甲氨基吡啶 作用下， 以 二氯甲烷 为溶剂， 反应 1.0h， 生成 2-[4-(2-hydroxy-2-methyl-propanoyl)phenoxy]ethyl 2-oxo-2-phenyl-acetate
  参考文献：
  名称：

  [EN] HYBRID PHOTOINITIATORS
  [FR] PHOTOINITIATEURS HYBRIDES

  摘要：

  式(I)的化合物，其中m为1或2；R1、R2、R4和R5分别独立地为氢、C1-C4烷基、C5-C7环烷基、苯基、C1-C4烷氧基、C5-C7环烷氧基或苯氧基；若m为1，则R3具有上述给定的R1、R2、R4和R5中的一种含义；若m为2，则R3为二价基团；R6为氢或C1-C4烷基；R7为氢，若R6为氢，则R7还可以是C1-C4烷基；R8为(A)或(B)基团，X为O、O-CH2-或-O(CHR14)-；n为0-10；条件是(i)若n为0，且X为O，则R8为A基团；(ii)若n不为0，则X为O且R8为A基团；R9和R10分别独立地为氢或C1-C4烷基；R11和R12分别独立地为C1-C4烷基，或与它们所连接的碳原子形成一个5到7元饱和碳环；R13为氢、C1-C4烷基、C5-C7环烷基、2-四氢吡喃基或Si(C1-C4烷基)3；R14为(A')基团；R'13具有上述给定的R13的含义之一，或为(C)基团；是有效的光引发剂化合物。

  公开号：

  WO2014060450A1

文献信息

• HYBRID PHOTOINITIATORS
  申请人：NESVADBA PETER

  公开号：US20160168279A1

  公开（公告）日：2016-06-16

  Compounds of the formula I wherein m is 1 or 2; R 1 , R 2 , R 4 and R 5 independently of one another are hydrogen, C 1 -C 4 alkyl, C 5 -C 7 cycloalkyl, phenyl, C 1 -C 4 alkoxy, C 5 -C 7 cycloalkoxy or phenoxy; R 3 , if m is 1, has one of the meanings as given above for R 1 , R 2 , R 4 and R 5 ; R 3 , if m is 2, is a divalent group; R 6 is hydrogen or C 1 -C 4 alkyl; R 7 is hydrogen, and if R 6 is hydrogen then R 7 may additionally be C 1 -C 4 alkyl; R 8 is group A or B X is O, O—CH 2 — or —O(CHR 14 )—; n is 0-10; provided that (i) if n is 0, and X is O, then R 8 is a group A; (ii) if n is other than 0, then X is O and R 8 is the group A; R 9 and R 10 independently of one another are hydrogen or C 1 -C 4 alkyl; R 11 and R 12 independently of one another are C 1 -C 4 alkyl or form together with the C atom to which they are attached a 5 to 7 membered saturated carbocyclic ring; R 13 is hydrogen, C 1 -C 4 alkyl, C 5 -C 7 cycloalkyl, 2-tetrahydropyranyl or Si(C 1 -C 4 alkyl) 3 ; R 14 is a group A′ and R′ 13 has one of the meanings as given for R 13 or is the group C are effective photoinitiator compounds.

  化合物的公式为I，其中m为1或2；R1、R2、R4和R5彼此独立地为氢、C1-C4烷基、C5-C7环烷基、苯基、C1-C4烷氧基、C5-C7环烷氧基或苯氧基；如果m为1，R3具有上述R1、R2、R4和R5中的一个意义，如果m为2，则R3是一个二价基团；R6为氢或C1-C4烷基；R7为氢，如果R6为氢，则R7还可以是C1-C4烷基；R8为A基团或BX，其中X为O、O—CH2—或—O(CHR14)—；n为0-10；前提是：（i）如果n为0且X为O，则R8为A基团；（ii）如果n不为0，则X为O且R8为A基团；R9和R10彼此独立地为氢或C1-C4烷基；R11和R12彼此独立地为C1-C4烷基，或者与它们所连接的碳原子形成一个5到7个成员的饱和碳环；R13为氢、C1-C4烷基、C5-C7环烷基、2-四氢吡喃基或Si(C1-C4烷基)3；R14为A′基团，R′13具有上述R13的一个意义，或者是C基团，是有效的光引发剂化合物。
• EP2909165A1
  申请人：——

  公开号：EP2909165A1

  公开（公告）日：2015-08-26
• US9701762B2
  申请人：——

  公开号：US9701762B2

  公开（公告）日：2017-07-11
• [EN] HYBRID PHOTOINITIATORS<br/>[FR] PHOTOINITIATEURS HYBRIDES
  申请人：BASF SE

  公开号：WO2014060450A1

  公开（公告）日：2014-04-24

  Compounds of the formula (I), wherein m is 1 or 2; R1, R2, R4 and R5 independently of one another are hydrogen, C1-C4alkyl, C5-C7 cyclo-alkyl, phenyl, C1-C4alkoxy, C5-C7cycloalkoxy or phenoxy; R3, if m is 1, has one of the meanings as given above for R1, R2, R4 and R5; R3, if m is 2, is a divalent group; R6 is hydrogen or C1-C4alkyl; R7 is hydrogen, and if R6 is hydrogen then R7 may additionally be C1-C4alkyl; R8 is group (A) or (B) X is O, O-CH2- or -O(CHR14)-; n is 0-10; provided that(i) if n is 0, and X is O, then R8 is a group A; (ii) if n is other than 0, then X is O and R8 is the group A; R9 and R10 independently of one another are hydrogen or C1-C4alkyl; R11 and R12 independently of one another are C1-C4alkyl or form together with the C atom to which they are attached a 5 to 7 membered saturated carbocyclic ring; R13 is hydrogen, C1-C4alkyl, C5-C7cycloalkyl, 2-tetrahydropyranyl or Si(C1-C4alkyl)3; R14 is a group (A'); and R'13 has one of the meanings as given for R13 or is the group (C); are effective photoinitiator compounds.

  式(I)的化合物，其中m为1或2；R1、R2、R4和R5分别独立地为氢、C1-C4烷基、C5-C7环烷基、苯基、C1-C4烷氧基、C5-C7环烷氧基或苯氧基；若m为1，则R3具有上述给定的R1、R2、R4和R5中的一种含义；若m为2，则R3为二价基团；R6为氢或C1-C4烷基；R7为氢，若R6为氢，则R7还可以是C1-C4烷基；R8为(A)或(B)基团，X为O、O-CH2-或-O(CHR14)-；n为0-10；条件是(i)若n为0，且X为O，则R8为A基团；(ii)若n不为0，则X为O且R8为A基团；R9和R10分别独立地为氢或C1-C4烷基；R11和R12分别独立地为C1-C4烷基，或与它们所连接的碳原子形成一个5到7元饱和碳环；R13为氢、C1-C4烷基、C5-C7环烷基、2-四氢吡喃基或Si(C1-C4烷基)3；R14为(A')基团；R'13具有上述给定的R13的含义之一，或为(C)基团；是有效的光引发剂化合物。