Chem
J-GLOBAL ID:200907056311433208   Nikkaji number:J1.364.905G

N-(2,5-Di-tert-butylphenyl)-1,6-bis(4-tert-butylphenoxy)-9-phenylperylene-3,4-dicarbimide

N-(2,5-ジ-tert-ブチルフェニル)-1,6-ビス(4-tert-ブチルフェノキシ)-9-フェニルペリレン-3,4-ジカルボイミド
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: C62H59NO4
Molecular formula furigana: C62-H59-N-O4
Molecular weight: 882.157
InChI: InChI=1S/C62H59NO4/c1-59(2,3)37-21-26-40(27-22-37)66-50-34-46-53-47(58(65)63(57(46)64)49-33-39(61(7,8)9)25-32-48(49)62(10,11)12)35-51(67-41-28-23-38(24-29-41)60(4,5)6)55-45-31-30-42(36-17-14-13-15-18-36)43-19-16-20-44(52(43)45)54(50)56(53)55/h13-35H,1-12H3
InChI key: LFAOHCFSAWLIJR-UHFFFAOYSA-N
SMILES: CC(C)(C)c1ccc(Oc2cc3c4c(cc(Oc5ccc(cc5)C(C)(C)C)c5c6ccc(c7ccccc7)c7cccc(c2c45)c67)c(=O)n(c2cc(ccc2C(C)(C)C)C(C)(C)C)c3=O)cc1
Systematic name  (3):
  • N-(2,5-ジ-tert-ブチルフェニル)-1,6-ビス(4-tert-ブチルフェノキシ)-9-フェニルペリレン-3,4-ジカルボイミド
  • 12,20-ビス(4-tert-ブチルフェノキシ)-16-(2,5-ジ-tert-ブチルフェニル)-5-フェニル-16-アザヘキサシクロ[12.6.2.12,6.011,21.018,22.010,23]トリコサ-1(20),2,4,6,8,10(23),11,13,18,21-デカエン-15,17-ジオン
  • 12,20-bis(4-tert-butylphenoxy)-16-(2,5-di-tert-butylphenyl)-5-phenyl-16-azahexacyclo[12.6.2.12,6.011,21.018,22.010,23]tricosa-1(20),2,4,6,8,10(23),11,13,18,21-decaene-15,17-dione
Other name (1):
  • N-(2,5-Di-tert-butylphenyl)-1,6-bis(4-tert-butylphenoxy)-9-phenylperylene-3,4-dicarbimide
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