Chem
J-GLOBAL ID：200907089239066004   Nikkaji number：J1.368.884B

3,8-Bis[3,5-bis[3,5-bis(4-tert-butylphenyl)phenyl]phenyl]-1,10-phenanthroline

3,8-ビス[3,5-ビス[3,5-ビス(4-tert-ブチルフェニル)フェニル]フェニル]-1,10-フェナントロリン
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： C128H128N2
Molecular formula furigana： C128-H128-N2
Molecular weight： 1694.446
InChI： InChI=1S/C128H128N2/c1-121(2,3)111-43-27-81(28-44-111)91-61-92(82-29-45-112(46-30-82)122(4,5)6)66-99(65-91)103-73-104(100-67-93(83-31-47-113(48-32-83)123(7,8)9)62-94(68-100)84-33-49-114(50-34-84)124(10,11)12)76-107(75-103)109-59-89-25-26-90-60-110(80-130-120(90)119(89)129-79-109)108-77-105(101-69-95(85-35-51-115(52-36-85)125(13,14)15)63-96(70-101)86-37-53-116(54-38-86)126(16,17)18)74-106(78-108)102-71-97(87-39-55-117(56-40-87)127(19,20)21)64-98(72-102)88-41-57-118(58-42-88)128(22,23)24/h25-80H,1-24H3
InChI key： JJTHEYWEIDMNHF-UHFFFAOYSA-N
SMILES： CC(C)(C)c1ccc(cc1)c1cc(cc(c1)c1cc(cc(c1)c1cc(cc(c1)c1ccc(cc1)C(C)(C)C)c1ccc(cc1)C(C)(C)C)c1cnc2c(ccc3cc(cnc23)c2cc(cc(c2)c2cc(cc(c2)c2ccc(cc2)C(C)(C)C)c2ccc(cc2)C(C)(C)C)c2cc(cc(c2)c2ccc(cc2)C(C)(C)C)c2ccc(cc2)C(C)(C)C)c1)c1ccc(cc1)C(C)(C)C
Systematic name  (3)：
  • 3,8-ビス[3,5-ビス[3,5-ビス(4-tert-ブチルフェニル)フェニル]フェニル]-1,10-フェナントロリン
  • 3,8-ビス({3,5-ビス[4'-tert-ブチル-5-(4-tert-ブチルフェニル)-[1,1'-ビフェニル]-3-イル]フェニル})-1,10-フェナントロリン
  • 3,8-bis({3,5-bis[4'-tert-butyl-5-(4-tert-butylphenyl)-[1,1'-biphenyl]-3-yl]phenyl})-1,10-phenanthroline
Other name (1)：
  • 3,8-Bis[3,5-bis[3,5-bis(4-tert-butylphenyl)phenyl]phenyl]-1,10-phenanthroline
Thsaurus map：
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