Chem
J-GLOBAL ID：200907081336083915
Nikkaji number：J2.064.864C
1,1′-(2,2′-Bithiophene-4,4′-diyl)bis[2-(3-thienyl)-3,4-bis(2,4,6-tri-tert-butylphenylphosphinediyl)cyclobutene]
1,1′-(2,2′-ビチオフェン-4,4′-ジイル)ビス[2-(3-チエニル)-3,4-ビス(2,4,6-トリ-tert-ブチルフェニルホスフィンジイル)シクロブテン]
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
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
Molecular formula： C96H126P4S4
Molecular formula furigana： C96-H126-P4-S4
Molecular weight： 1532.200
InChI：
InChI=1S/C96H126P4S4/c1-85(2,3)59-43-63(89(13,14)15)77(64(44-59)90(16,17)18)97-81-73(55-37-39-101-51-55)75(83(81)99-79-67(93(25,26)27)47-61(87(7,8)9)48-68(79)94(28,29)30)57-41-71(103-53-57)72-42-58(54-104-72)76-74(56-38-40-102-52-56)82(98-78-65(91(19,20)21)45-60(86(4,5)6)46-66(78)92(22,23)24)84(76)100-80-69(95(31,32)33)49-62(88(10,11)12)50-70(80)96(34,35)36/h37-54H,1-36H3
InChI key：
OLGNWGFQTXXFOR-UHFFFAOYSA-N
SMILES：
CC(C)(C)c1cc(c(P=C2C(=C(c3csc(c3)c3cc(cs3)C3=C(c4ccsc4)C(=Pc4c(cc(cc4C(C)(C)C)C(C)(C)C)C(C)(C)C)C3=Pc3c(cc(cc3C(C)(C)C)C(C)(C)C)C(C)(C)C)C2=Pc2c(cc(cc2C(C)(C)C)C(C)(C)C)C(C)(C)C)c2ccsc2)c(c1)C(C)(C)C)C(C)(C)C
Systematic name (3)：
- 1,1′-(2,2′-ビチオフェン-4,4′-ジイル)ビス[2-(3-チエニル)-3,4-ビス(2,4,6-トリ-tert-ブチルフェニルホスフィンジイル)シクロブテン]
- [2-(チオフェン-3-イル)-3-{4'-[2-(チオフェン-3-イル)-3,4-ビス[(2,4,6-トリ-tert-ブチルフェニル)ホスファニリデン]シクロブタ-1-エン-1-イル]-[2,2'-ビチオフェン]-4-イル}-4-[(2,4,6-トリ-tert-ブチルフェニル)ホスファニリデン]シクロブタ-2-エン-1-イリデン](2,4,6-トリ-tert-ブチルフェニル)ホスファン
- [2-(thiophen-3-yl)-3-{4'-[2-(thiophen-3-yl)-3,4-bis[(2,4,6-tri-tert-butylphenyl)phosphanylidene]cyclobut-1-en-1-yl]-[2,2'-bithiophen]-4-yl}-4-[(2,4,6-tri-tert-butylphenyl)phosphanylidene]cyclobut-2-en-1-ylidene](2,4,6-tri-tert-butylphenyl)phosphane
- 1,1′-(2,2′-Bithiophene-4,4′-diyl)bis[2-(3-thienyl)-3,4-bis(2,4,6-tri-tert-butylphenylphosphinediyl)cyclobutene]
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