Chem
J-GLOBAL ID:200907067273170640
Nikkaji number:J2.192.221H
Bis[10-(2,6-dimethyl-4-tert-butylphenyl)-2-(4-pyridyl)-9-anthryl]carbene
ビス[10-(2,6-ジメチル-4-tert-ブチルフェニル)-2-(4-ピリジル)-9-アントリル]カルベン
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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:
C63 H56 N2
Molecular formula furigana:
C63-H56-N2
Molecular weight:
841.155
InChI:
InChI=1S/C63H56N2/c1-38-31-46(62(5,6)7)32-39(2)58(38)60-50-17-13-11-15-48(50)56(54-35-44(19-21-52(54)60)42-23-27-64-28-24-42)37-57-49-16-12-14-18-51(49)61(59-40(3)33-47(34-41(59)4)63(8,9)10)53-22-20-45(36-55(53)57)43-25-29-65-30-26-43/h11-36H,1-10H3
InChI key:
TYEIXKAXNKAXTI-UHFFFAOYSA-N
SMILES:
Cc1cc(cc(C)c1c1c2ccccc2c([C]c2c3ccccc3c(c3c(C)cc(cc3C)C(C)(C)C)c3ccc(cc23)c2ccncc2)c2cc(ccc12)c1ccncc1)C(C)(C)C
Systematic name (3):
ビス[10-(2,6-ジメチル-4-tert-ブチルフェニル)-2-(4-ピリジル)-9-アントリル]カルベン
ビス[10-(4-tert-ブチル-2,6-ジメチルフェニル)-2-(ピリジン-4-イル)アントラセン-9-イル]メチリデン
bis[10-(4-tert-butyl-2,6-dimethylphenyl)-2-(pyridin-4-yl)anthracen-9-yl]methylidene
Other name (1):
Bis[10-(2,6-dimethyl-4-tert-butylphenyl)-2-(4-pyridyl)-9-anthryl]carbene
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