Bis[4-(3-hydroxy-3-methylbut-1-en-2-yl)phenyl]methyl 2-oxo-2-phenylacetate

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: Bis[4-(3-hydroxy-3-methylbut-1-en-2-yl)phenyl]methyl 2-oxo-2-phenylacetate
• 英文别名: bis[4-(3-hydroxy-3-methylbut-1-en-2-yl)phenyl]methyl 2-oxo-2-phenylacetate
• 化学式: C₃₁H₃₂O₅
• 分子量: 484.6
• InChiKey: XDZHAYSMCMYXTQ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.3
• 重原子数：
  36
• 可旋转键数：
  10
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.23
• 拓扑面积：
  83.8
• 氢给体数：
  2
• 氢受体数：
  5

文献信息

• [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。