Chem
J-GLOBAL ID:200907050284798810   Nikkaji number:J1.989.267K

5,10,15,20-Tetrakis(2-thienyl)-2,3-(4,5-dichloronaphthalene-1,8-diyl)-7,8-(4,5-dichloronaphthalene-1,8-diyl)-12,13-(4,5-dichloronaphthalene-1,8-diyl)-17,18-(4,5-dichloronaphthalene-1,8-diyl)-21H,23H-porphyrin

5,10,15,20-テトラキス(2-チエニル)-2,3-(4,5-ジクロロナフタレン-1,8-ジイル)-7,8-(4,5-ジクロロナフタレン-1,8-ジイル)-12,13-(4,5-ジクロロナフタレン-1,8-ジイル)-17,18-(4,5-ジクロロナフタレン-1,8-ジイル)-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: C76H30Cl8N4S4
Molecular formula furigana: C76-H30-CL8-N4-S4
Molecular weight: 1410.940
InChI: InChI=1S/C76H30Cl8N4S4/c77-37-17-9-29-49-31(11-19-39(79)61(37)49)55-53(29)69-65(45-5-1-25-89-45)70-54-30-10-18-38(78)62-40(80)20-12-32(50(30)62)56(54)72(86-70)67(47-7-3-27-91-47)74-58-34-14-22-42(82)64-44(84)24-16-36(52(34)64)60(58)76(88-74)68(48-8-4-28-92-48)75-59-35-15-23-43(83)63-41(81)21-13-33(51(35)63)57(59)73(87-75)66(71(55)85-69)46-6-2-26-90-46/h1-28,85,88H/b69-65-,70-65-,71-66-,72-67-,73-66-,74-67-,75-68-,76-68-
InChI key: QZNLPNGJTYGASJ-CDOXUQPXSA-N
SMILES: Clc1ccc2c3=c(c4n/c/3=C(\c3[nH]c(/C(=c/5\nc(/C(=c/6\[nH]/c(=C\4/c4cccs4)/c4c6c6ccc(Cl)c7c(Cl)ccc4c67)/c4cccs4)c4=c5c5ccc(Cl)c6c(Cl)ccc4c56)/c4cccs4)c4c3c3ccc(Cl)c5c(Cl)ccc4c35)/c3cccs3)c3ccc(Cl)c1c23
Systematic name  (3):
  • 5,10,15,20-テトラキス(2-チエニル)-2,3-(4,5-ジクロロナフタレン-1,8-ジイル)-7,8-(4,5-ジクロロナフタレン-1,8-ジイル)-12,13-(4,5-ジクロロナフタレン-1,8-ジイル)-17,18-(4,5-ジクロロナフタレン-1,8-ジイル)-21H,23H-ポルフィリン
  • 8,10,22,24,36,38,50,52-オクタクロロ-2,16,30,44-テトラキス(チオフェン-2-イル)-57,59,61,63-テトラアザヘプタデカシクロ[43.11.1.13,15.15,9.117,29.119,23.131,43.133,37.147,51.04,14.018,28.032,42.046,56.013,64.027,62.041,60.055,58]テトラヘキサコンタ-1,3,5,7,9,11,13(64),14,16,18(28),19(62),20,22,24,26,29(61),30,32(42),33(60),34,36,38,40,43,45(57),46(56),47,49,51(58),52,54-ヘントリアコンタエン
  • 8,10,22,24,36,38,50,52-octachloro-2,16,30,44-tetrakis(thiophen-2-yl)-57,59,61,63-tetraazaheptadecacyclo[43.11.1.13,15.15,9.117,29.119,23.131,43.133,37.147,51.04,14.018,28.032,42.046,56.013,64.027,62.041,60.055,58]tetrahexaconta-1,3,5,7,9,11,13(64),14,16,18(28),19(62),20,22,24,26,29(61),30,32(42),33(60),34,36,38,40,43,45(57),46(56),47,49,51(58),52,54-hentriacontaene
Other name (1):
  • 5,10,15,20-Tetrakis(2-thienyl)-2,3-(4,5-dichloronaphthalene-1,8-diyl)-7,8-(4,5-dichloronaphthalene-1,8-diyl)-12,13-(4,5-dichloronaphthalene-1,8-diyl)-17,18-(4,5-dichloronaphthalene-1,8-diyl)-21H,23H-porphyrin
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