Chem
J-GLOBAL ID:200907031461760441   Nikkaji number:J2.142.126J

4,4′-Bi[5-[bis(3,5-di-tert-butylphenyl)phosphino]-1,3-benzodioxole]

4,4′-ビ[5-[ビス(3,5-ジ-tert-ブチルフェニル)ホスフィノ]-1,3-ベンゾジオキソール]
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: C70H92O4P2
Molecular formula furigana: C70-H92-O4-P2
Molecular weight: 1059.450
InChI: InChI=1S/C70H92O4P2/c1-63(2,3)43-29-44(64(4,5)6)34-51(33-43)75(52-35-45(65(7,8)9)30-46(36-52)66(10,11)12)57-27-25-55-61(73-41-71-55)59(57)60-58(28-26-56-62(60)74-42-72-56)76(53-37-47(67(13,14)15)31-48(38-53)68(16,17)18)54-39-49(69(19,20)21)32-50(40-54)70(22,23)24/h25-40H,41-42H2,1-24H3
InChI key: CJSXGDKLBVVONE-UHFFFAOYSA-N
SMILES: CC(C)(C)c1cc(cc(c1)C(C)(C)C)P(c1cc(cc(c1)C(C)(C)C)C(C)(C)C)c1ccc2OCOc2c1c1c2OCOc2ccc1P(c1cc(cc(c1)C(C)(C)C)C(C)(C)C)c1cc(cc(c1)C(C)(C)C)C(C)(C)C
Systematic name  (4):
  • 4,4′-ビ[5-[ビス(3,5-ジ-tert-ブチルフェニル)ホスフィノ]-1,3-ベンゾジオキソール]
  • 5,5′-ビス[ビス(3,5-ジ-tert-ブチルフェニル)ホスフィノ]-4,4′-ビ[1,3-ベンゾジオキソール]
  • (4-{5-[ビス(3,5-ジ-tert-ブチルフェニル)ホスファニル]-2H-1,3-ベンゾジオキソール-4-イル}-2H-1,3-ベンゾジオキソール-5-イル)ビス(3,5-ジ-tert-ブチルフェニル)ホスファン
  • (4-{5-[bis(3,5-di-tert-butylphenyl)phosphanyl]-2H-1,3-benzodioxol-4-yl}-2H-1,3-benzodioxol-5-yl)bis(3,5-di-tert-butylphenyl)phosphane
Other name (2):
  • 4,4′-Bi[5-[bis(3,5-di-tert-butylphenyl)phosphino]-1,3-benzodioxole]
  • 5,5′-Bis[bis(3,5-di-tert-butylphenyl)phosphino]-4,4′-bi[1,3-benzodioxole]
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