Chem
J-GLOBAL ID：200907083858090680   Nikkaji number：J692.405K

2,3,6,7,10,11-Hexakis[2-oxo-2-(12,12,12,11,11,10,10,9,9,8,8,7,7,6,6,5,5,4,4,3,3-henicosafluorododecyloxy)ethoxy]triphenylene

2,3,6,7,10,11-ヘキサキス[2-オキソ-2-(12,12,12,11,11,10,10,9,9,8,8,7,7,6,6,5,5,4,4,3,3-ヘニコサフルオロドデシルオキシ)エトキシ]トリフェニレン
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C102H42F126O18
Molecular formula furigana： C102-H42-F126-O18
Molecular weight： 3949.239
InChI： InChI=1S/C102H42F126O18/c103-43(104,49(115,116)55(127,128)61(139,140)67(151,152)73(163,164)79(175,176)85(187,188)91(199,200)97(211,212)213)1-7-235-37(229)19-241-31-13-25-26(14-32(31)242-20-38(230)236-8-2-44(105,106)50(117,118)56(129,130)62(141,142)68(153,154)74(165,166)80(177,178)86(189,190)92(201,202)98(214,215)216)28-16-34(244-22-40(232)238-10-4-46(109,110)52(121,122)58(133,134)64(145,146)70(157,158)76(169,170)82(181,182)88(193,194)94(205,206)100(220,221)222)36(246-24-42(234)240-12-6-48(113,114)54(125,126)60(137,138)66(149,150)72(161,162)78(173,174)84(185,186)90(197,198)96(209,210)102(226,227)228)18-30(28)29-17-35(245-23-41(233)239-11-5-47(111,112)53(123,124)59(135,136)65(147,148)71(159,160)77(171,172)83(183,184)89(195,196)95(207,208)101(223,224)225)33(15-27(25)29)243-21-39(231)237-9-3-45(107,108)51(119,120)57(131,132)63(143,144)69(155,156)75(167,168)81(179,180)87(191,192)93(203,204)99(217,218)219/h13-18H,1-12,19-24H2
InChI key： YFVVWTKASBQTEP-UHFFFAOYSA-N
SMILES： FC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)CCOC(=O)COc1cc2c(cc1OCC(=O)OCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)c1cc(OCC(=O)OCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)c(OCC(=O)OCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)cc1c1cc(OCC(=O)OCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)c(OCC(=O)OCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)cc21
Systematic name  (3)：
  • 2,3,6,7,10,11-ヘキサキス[2-オキソ-2-(12,12,12,11,11,10,10,9,9,8,8,7,7,6,6,5,5,4,4,3,3-ヘニコサフルオロドデシルオキシ)エトキシ]トリフェニレン
  • 3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-ヘンイコサフルオロドデシル 2-{[3,6,7,10,11-ペンタキス({2-[(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-ヘンイコサフルオロドデシル)オキシ]-2-オキソエトキシ})トリフェニレン-2-イル]オキシ}アセタート
  • 3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-henicosafluorododecyl 2-{[3,6,7,10,11-pentakis({2-[(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,12-henicosafluorododecyl)oxy]-2-oxoethoxy})triphenylen-2-yl]oxy}acetate
Other name (1)：
  • 2,3,6,7,10,11-Hexakis[2-oxo-2-(12,12,12,11,11,10,10,9,9,8,8,7,7,6,6,5,5,4,4,3,3-henicosafluorododecyloxy)ethoxy]triphenylene
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