Chem
J-GLOBAL ID:200907097398847249
Nikkaji number:J848.953J
[(3,5-Di-tert-butyl-4-hydroxyphenyl)bis(3,6-di-tert-butylazulen-1-yl)methyl]cation
(3,5-ジ-tert-ブチル-4-ヒドロキシフェニル)ビス(3,6-ジ-tert-ブチルアズレン-1-イル)メチリウム
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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:
C50 [C+]H67 O
Molecular formula furigana:
C51-H67-O
Molecular weight:
696.095
InChI:
InChI=1S/C51H66O/c1-46(2,3)32-19-23-34-36(25-21-32)40(48(7,8)9)29-38(34)44(31-27-42(50(13,14)15)45(52)43(28-31)51(16,17)18)39-30-41(49(10,11)12)37-26-22-33(47(4,5)6)20-24-35(37)39/h19-30H,1-18H3/p+1
InChI key:
RQLIAHNVRGALLM-UHFFFAOYSA-O
SMILES:
CC(C)(C)c1cc([C+](c2cc(c3ccc(ccc23)C(C)(C)C)C(C)(C)C)c2cc(c(O)c(c2)C(C)(C)C)C(C)(C)C)c2ccc(ccc12)C(C)(C)C
Systematic name (3):
[(3,5-ジ-tert-ブチル-4-ヒドロキシフェニル)ビス(3,6-ジ-tert-ブチルアズレン-1-イル)メチル]カチオン
(3,5-ジ-tert-ブチル-4-ヒドロキシフェニル)ビス(3,6-ジ-tert-ブチルアズレン-1-イル)メチリウム
(3,5-di-tert-butyl-4-hydroxyphenyl)bis(3,6-di-tert-butylazulen-1-yl)methylium
Other name (1):
[(3,5-Di-tert-butyl-4-hydroxyphenyl)bis(3,6-di-tert-butylazulen-1-yl)methyl]cation
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