Chem
J-GLOBAL ID：200907054618184369
Nikkaji number：J1.624.443K
1,1′,10,10′-(1,2-Difluoro-1,1,2,2-ethanetetryl)-1′′,6′,7′,10′′-(1,2-difluoro-1,1,2,2-ethanetetryl)-6,6′′,7,7′′-(1,2-difluoro-1,1,2,2-ethanetetryl)-4,3,3′,4′,3′′,4′′-(1,2,3,4,5,6-hexafluoro-1,2,3,4,5,6-cyclohexanehexyl)-5,5′′:8,8′′:8′,9′′:9,9′-tetrakiscyclo-2,2′:5′,2′′-ter[1,2,3,4,5,6,7,8,9,10-decafluoro-1,2,3,4,5,6,7,8,9,10-decahydrofluoranthene]
1,1′,10,10′-(1,2-ジフルオロ-1,1,2,2-エタンテトライル)-1′′,6′,7′,10′′-(1,2-ジフルオロ-1,1,2,2-エタンテトライル)-6,6′′,7,7′′-(1,2-ジフルオロ-1,1,2,2-エタンテトライル)-4,3,3′,4′,3′′,4′′-(1,2,3,4,5,6-ヘキサフルオロ-1,2,3,4,5,6-シクロヘキサンヘキサイル)-5,5′′:8,8′′:8′,9′′:9,9′-テトラキスシクロ-2,2′:5′,2′′-テル[1,2,3,4,5,6,7,8,9,10-デカフルオロ-1,2,3,4,5,6,7,8,9,10-デカヒドロフルオランテン]
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
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
Molecular formula： C60F42
Molecular formula furigana： C60-F42
Molecular weight： 1518.593
InChI：
InChI=1S/C60F42/c61-19-4-1-5-11-10(4)25(67)40(82)27(69)12-6-2-8-14(12)29(71)42(84)30(72)15-9-3-7-13(15)28(70)41(83,26(11,68)50(92)49(25,91)51(27,93)53(29,95)54(30,96)52(28,50)94)38(80)20(5,62)44(86)32(74)16(1)31(73)43(19,85)45(87,21(6,63)37(19,40)79)33(75)17(2)35(77)47(89)23(8,65)39(42,81)24(9,66)48(47,90)36(78)18(3)34(76,46(44,88)22(7,38)64)58(100)56(32,98)55(31,97)57(33,99)59(35,101)60(36,58)102
InChI key：
FQWBNEXLFFYJHE-UHFFFAOYSA-N
SMILES：
FC12C3=C4C5=C6C3=C3C7(F)C1(F)C1(F)C8(F)C9=C%10C%11=C%12C9=C9C1(F)C1(F)C7(F)C7(F)C3(F)C3(F)C6(F)C6(F)C%13(F)C%14=C%15C%16=C%17C%14=C%14C(F)(C3%13F)C7(F)C3(F)C%14(F)C7(F)C%17(F)C(F)(C%12(F)C7(F)C9(F)C13F)C1(F)C%11(F)C3(F)C7(F)C%10(F)C(F)(C4(F)C7(F)C4(F)C5(F)C6(F)C%15(F)C4(F)C3(F)C%161F)C28F
Systematic name (3)：
- 1,1′,10,10′-(1,2-ジフルオロ-1,1,2,2-エタンテトライル)-1′′,6′,7′,10′′-(1,2-ジフルオロ-1,1,2,2-エタンテトライル)-6,6′′,7,7′′-(1,2-ジフルオロ-1,1,2,2-エタンテトライル)-4,3,3′,4′,3′′,4′′-(1,2,3,4,5,6-ヘキサフルオロ-1,2,3,4,5,6-シクロヘキサンヘキサイル)-5,5′′:8,8′′:8′,9′′:9,9′-テトラキスシクロ-2,2′:5′,2′′-テル[1,2,3,4,5,6,7,8,9,10-デカフルオロ-1,2,3,4,5,6,7,8,9,10-デカヒドロフルオランテン]
- ドテトラコンタフルオロヘントリアコンタシクロ[13.12.27.617,19.02,6.04,16.05,13.07,11.08,28.09,31.010,34.012,36.014,37.018,54.020,52.021,49.023,47.025,46.026,29.030,45.032,44.033,41.035,40.038,53.039,51.042,50.043,48.03,59.022,55.024,57.027,58.056,60]ヘキサコンタ-2,4(16),5,22,24,33(41),34,39,46-ノナエン
- dotetracontafluorohentriacontacyclo[13.12.27.617,19.02,6.04,16.05,13.07,11.08,28.09,31.010,34.012,36.014,37.018,54.020,52.021,49.023,47.025,46.026,29.030,45.032,44.033,41.035,40.038,53.039,51.042,50.043,48.03,59.022,55.024,57.027,58.056,60]hexaconta-2,4(16),5,22,24,33(41),34,39,46-nonaene
- 1,1′,10,10′-(1,2-Difluoro-1,1,2,2-ethanetetryl)-1′′,6′,7′,10′′-(1,2-difluoro-1,1,2,2-ethanetetryl)-6,6′′,7,7′′-(1,2-difluoro-1,1,2,2-ethanetetryl)-4,3,3′,4′,3′′,4′′-(1,2,3,4,5,6-hexafluoro-1,2,3,4,5,6-cyclohexanehexyl)-5,5′′:8,8′′:8′,9′′:9,9′-tetrakiscyclo-2,2′:5′,2′′-ter[1,2,3,4,5,6,7,8,9,10-decafluoro-1,2,3,4,5,6,7,8,9,10-decahydrofluoranthene]
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