Chem
J-GLOBAL ID:200907074649688080   Nikkaji number:J2.452.439F

1,20-[1,6,11-Tris(pentafluorophenyl)-2,5-epinitrilo-7,10:12,15-diepimino-1,3,6,8,10,12,14-pentadecaheptaene-1,15-diyl]-5,10,15,20-tetrakis(pentafluorophenyl)-1,20-seco-21H,23H-porphyrin

1,20-[1,6,11-トリス(ペンタフルオロフェニル)-2,5-エピニトリロ-7,10:12,15-ジエピミノ-1,3,6,8,10,12,14-ペンタデカヘプタエン-1,15-ジイル]-5,10,15,20-テトラキス(ペンタフルオロフェニル)-1,20-セコ-21H,23H-ポルフィリン
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: C77H18F35N7
Molecular formula furigana: C77-H18-F35-N7
Molecular weight: 1705.984
InChI: InChI=1S/C77H18F35N7/c78-43-36(44(79)58(93)71(106)57(43)92)29-15-1-2-16(113-15)30(37-45(80)59(94)72(107)60(95)46(37)81)18-5-6-20(115-18)32(39-49(84)63(98)74(109)64(99)50(39)85)22-9-10-24(117-22)34(41-53(88)67(102)76(111)68(103)54(41)89)26-13-14-28(119-26)35(42-55(90)69(104)77(112)70(105)56(42)91)27-12-11-25(118-27)33(40-51(86)65(100)75(110)66(101)52(40)87)23-8-7-21(116-23)31(19-4-3-17(29)114-19)38-47(82)61(96)73(108)62(97)48(38)83/h1-14,113-114,117-118H/b29-15+,29-17+,30-16+,30-18+,31-19+,31-21+,32-20+,32-22-,33-23+,33-25+,34-24-,34-26+,35-27+,35-28+
InChI key: QFIOWMZTRLLEPR-PFPKNVAFSA-N
SMILES: Fc1c(F)c(F)c(c(F)c1F)/C/1=c/2\cc/c(=C(/C3=N/C(=C(\c4ccc(/C(=c\5/cc/c(=C(/C6=N/C(=C(\c7ccc(/C(=C\8/C=CC1=N8)/c1c(F)c(F)c(F)c(F)c1F)[nH]7)/c1c(F)c(F)c(F)c(F)c1F)/C=C6)\c1c(F)c(F)c(F)c(F)c1F)/[nH]5)/c1c(F)c(F)c(F)c(F)c1F)[nH]4)/c1c(F)c(F)c(F)c(F)c1F)/C=C3)\c1c(F)c(F)c(F)c(F)c1F)/[nH]2
Systematic name  (5):
  • 2,7,12,17,22,27,32-ヘプタキス(ペンタフルオロフェニル)-36,37,38,39,40,41,42-ヘプタアザオクタシクロ[31.2.1.13,6.18,11.113,16.118,21.123,26.128,31]ドテトラコンタン-1,3,5,7,9,11,13(40),14,16,18,20,22,24,26(38),27,29,31,33(36),34-ノナデカエン
  • 5,10,15-トリス(ペンタフルオロフェニル)-20,25,30,35-テトラキス(ペンタフルオロフェニル)-1,4:11,14:21,24:26,29-テトラエピミノ-6,9:19,16:34,31-トリエピニトリロシクロペンタトリアコンタン-1,3,5,7,10,12,14,17,19,21,23,25,27,29,32,34-ヘキサデカエン
  • 2,7,12,17,22,27,32-ヘプタキス(ペンタフルオロフェニル)-36,37,38,39,40,41,42-ヘプタアザオクタシクロ[31.2.1.13,6.18,11.113,16.118,21.123,26.128,31]ドテトラコンタン-1,3(42),4,6,8,10,12,14,16,18(39),19,21,23,25,27,29,31(37),32,34-ノナデカエン
  • 2,7,12,17,22,27,32-ヘプタキス(ペンタフルオロフェニル)-36,37,38,39,40,41,42-ヘプタアザオクタシクロ[31.2.1.13,6.18,11.113,16.118,21.123,26.128,31]ドテトラコンタン-1(35),2,4,6(42),7,9,11,13(40),14,16,18,20,22,24,26,28(37),29,31,33-ノナデカエン
  • 1,20-[1,6,11-トリス(ペンタフルオロフェニル)-2,5-エピニトリロ-7,10:12,15-ジエピミノ-1,3,6,8,10,12,14-ペンタデカヘプタエン-1,15-ジイル]-5,10,15,20-テトラキス(ペンタフルオロフェニル)-1,20-セコ-21H,23H-ポルフィリン
Other name (5):
  • 2,7,12,17,22,27,32-Heptakis(pentafluorophenyl)-36,37,38,39,40,41,42-heptaazaoctacyclo[31.2.1.13,6.18,11.113,16.118,21.123,26.128,31]dotetracontane-1,3,5,7,9,11,13(40),14,16,18,20,22,24,26(38),27,29,31,33(36),34-nonadecaene
  • 5,10,15-Tris(pentafluorophenyl)-20,25,30,35-tetrakis(pentafluorophenyl)-1,4:11,14:21,24:26,29-tetraepimino-6,9:19,16:34,31-triepinitrilocyclopentatriacontane-1,3,5,7,10,12,14,17,19,21,23,25,27,29,32,34-hexadecaene
  • 2,7,12,17,22,27,32-Heptakis(pentafluorophenyl)-36,37,38,39,40,41,42-heptaazaoctacyclo[31.2.1.13,6.18,11.113,16.118,21.123,26.128,31]dotetracontane-1,3(42),4,6,8,10,12,14,16,18(39),19,21,23,25,27,29,31(37),32,34-nonadecaene
  • 2,7,12,17,22,27,32-Heptakis(pentafluorophenyl)-36,37,38,39,40,41,42-heptaazaoctacyclo[31.2.1.13,6.18,11.113,16.118,21.123,26.128,31]dotetracontane-1(35),2,4,6(42),7,9,11,13(40),14,16,18,20,22,24,26,28(37),29,31,33-nonadecaene
  • 1,20-[1,6,11-Tris(pentafluorophenyl)-2,5-epinitrilo-7,10:12,15-diepimino-1,3,6,8,10,12,14-pentadecaheptaene-1,15-diyl]-5,10,15,20-tetrakis(pentafluorophenyl)-1,20-seco-21H,23H-porphyrin
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