Chem
J-GLOBAL ID:201807014288836362   Nikkaji number:J3.726.385K

5,5′,5′′,15,15′,15′′-Hexakis[3,5-bis(3-methylbutoxy)phenyl]-10′′,20-bis[4-(tert-butyldiphenylsiloxy)phenyl]-10,20′:10′,20′′-ter(21H,23H-porphyrin)

5,5′,5′′,15,15′,15′′-ヘキサキス[3,5-ビス(3-メチルブトキシ)フェニル]-10′′,20-ビス[4-(tert-ブチルジフェニルシロキシ)フェニル]-10,20′:10′,20′′-テル(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: C200H226N12O14Si2
Molecular formula furigana: C200-H226-N12-O14-SI2
Molecular weight: 3078.248
InChI: InChI=1S/C200H226N12O14Si2/c1-125(2)83-95-213-147-107-139(108-148(119-147)214-96-84-126(3)4)189-167-63-59-163(201-167)187(137-51-55-145(56-52-137)225-227(199(25,26)27,159-43-35-31-36-44-159)160-45-37-32-38-46-160)164-60-64-168(202-164)190(140-109-149(215-97-85-127(5)6)120-150(110-140)216-98-86-128(7)8)172-68-76-180(206-172)195(179-75-67-171(189)205-179)197-183-79-71-175(209-183)193(143-115-155(221-103-91-133(17)18)123-156(116-143)222-104-92-134(19)20)177-73-81-185(211-177)198(186-82-74-178(212-186)194(176-72-80-184(197)210-176)144-117-157(223-105-93-135(21)22)124-158(118-144)224-106-94-136(23)24)196-181-77-69-173(207-181)191(141-111-151(217-99-87-129(9)10)121-152(112-141)218-100-88-130(11)12)169-65-61-165(203-169)188(138-53-57-146(58-54-138)226-228(200(28,29)30,161-47-39-33-40-48-161)162-49-41-34-42-50-162)166-62-66-170(204-166)192(174-70-78-182(196)208-174)142-113-153(219-101-89-131(13)14)122-154(114-142)220-102-90-132(15)16/h31-82,107-136,201,203,206,208-209,212H,83-106H2,1-30H3/b187-163-,187-164-,188-165-,188-166-,189-167-,189-171-,190-168-,190-172-,191-169-,191-173-,192-170-,192-174-,193-175-,193-177-,194-176-,194-178-,195-179+,195-180+,196-181+,196-182+,197-183+,197-184+,198-185+,198-186+
InChI key: QFVDIKDKQLPFCJ-JDLOTRQLSA-N
SMILES: CC(C)CCOc1cc(OCCC(C)C)cc(c1)/C/1=c/2\cc/c(=C(/C3=N/C(=C(\c4ccc(/C(=C\5/C=CC1=N5)/C/1=c/5\cc/c(=C(/C6=N/C(=C(\c7ccc(/C(=C\8/C=CC1=N8)/c1cc(OCCC(C)C)cc(OCCC(C)C)c1)[nH]7)/C/1=c/7\cc/c(=C(/C8=N/C(=C(\c9ccc(/C(=C\%10/C=CC1=N%10)/c1cc(OCCC(C)C)cc(OCCC(C)C)c1)[nH]9)/c1ccc(O[Si](c9ccccc9)(c9ccccc9)C(C)(C)C)cc1)/C=C8)\c1cc(OCCC(C)C)cc(OCCC(C)C)c1)/[nH]7)/C=C6)\c1cc(OCCC(C)C)cc(OCCC(C)C)c1)/[nH]5)[nH]4)/c1cc(OCCC(C)C)cc(OCCC(C)C)c1)/C=C3)\c1ccc(O[Si](c3ccccc3)(c3ccccc3)C(C)(C)C)cc1)/[nH]2
Systematic name  (3):
  • 5,5′,5′′,15,15′,15′′-ヘキサキス[3,5-ビス(3-メチルブトキシ)フェニル]-10′′,20-ビス[4-(tert-ブチルジフェニルシロキシ)フェニル]-10,20′:10′,20′′-テル(21H,23H-ポルフィリン)
  • 2,12-ビス[3,5-ビス(3-メチルブトキシ)フェニル]-7-{7,17-ビス[3,5-ビス(3-メチルブトキシ)フェニル]-12-{7,17-ビス[3,5-ビス(3-メチルブトキシ)フェニル]-12-{4-[(tert-ブチルジフェニルシリル)オキシ]フェニル}-21,22,23,24-テトラアザペンタシクロ[16.2.1.13,6.18,11.113,16]テトラコサ-1,3(24),4,6,8,10,12,14,16(22),17,19-ウンデカエン-2-イル}-21,22,23,24-テトラアザペンタシクロ[16.2.1.13,6.18,11.113,16]テトラコサ-1,3(24),4,6,8,10,12,14,16(22),17,19-ウンデカエン-2-イル}-17-{4-[(tert-ブチルジフェニルシリル)オキシ]フェニル}-21,22,23,24-テトラアザペンタシクロ[16.2.1.13,6.18,11.113,16]テトラコサ-1,3,5,7,9,11(23),12,14,16,18(21),19-ウンデカエン
  • 2,12-bis[3,5-bis(3-methylbutoxy)phenyl]-7-{7,17-bis[3,5-bis(3-methylbutoxy)phenyl]-12-{7,17-bis[3,5-bis(3-methylbutoxy)phenyl]-12-{4-[(tert-butyldiphenylsilyl)oxy]phenyl}-21,22,23,24-tetraazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1,3(24),4,6,8,10,12,14,16(22),17,19-undecaen-2-yl}-21,22,23,24-tetraazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1,3(24),4,6,8,10,12,14,16(22),17,19-undecaen-2-yl}-17-{4-[(tert-butyldiphenylsilyl)oxy]phenyl}-21,22,23,24-tetraazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1,3,5,7,9,11(23),12,14,16,18(21),19-undecaene
Other name (1):
  • 5,5′,5′′,15,15′,15′′-Hexakis[3,5-bis(3-methylbutoxy)phenyl]-10′′,20-bis[4-(tert-butyldiphenylsiloxy)phenyl]-10,20′:10′,20′′-ter(21H,23H-porphyrin)
Thsaurus map:

Return to Previous Page