Chem
J-GLOBAL ID:200907017828057707   Nikkaji number:J1.629.366K

2,4,8,10-Tetra-tert-butyl-6-[[(1α,5α)-2β,6,6-trimethylbicyclo[3.1.1]heptane-3α-yl]oxy]dibenzo[d,f][1,3,2]dioxaphosphepin

2,4,8,10-テトラ-tert-ブチル-6-[[(1α,5α)-2β,6,6-トリメチルビシクロ[3.1.1]ヘプタン-3α-イル]オキシ]ジベンゾ[d,f][1,3,2]ジオキサホスフェピン
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: C38H57O3P
Molecular formula furigana: C38-H57-O3-P
Molecular weight: 592.845
InChI: InChI=1S/C38H57O3P/c1-22-28-20-25(38(28,14)15)21-31(22)39-42-40-32-26(16-23(34(2,3)4)18-29(32)36(8,9)10)27-17-24(35(5,6)7)19-30(33(27)41-42)37(11,12)13/h16-19,22,25,28,31H,20-21H2,1-15H3/t22-,25+,28-,31-/m1/s1
InChI key: MWGTUVPRYJRHBH-MEIGDMOXSA-N
SMILES: C[C@@H]1[C@H]2C[C@@H](C[C@H]1Op1oc3c(cc(cc3C(C)(C)C)C(C)(C)C)c3cc(cc(c3o1)C(C)(C)C)C(C)(C)C)C2(C)C
Systematic name  (3):
  • 2,4,8,10-テトラ-tert-ブチル-6-[[(1α,5α)-2β,6,6-トリメチルビシクロ[3.1.1]ヘプタン-3α-イル]オキシ]ジベンゾ[d,f][1,3,2]ジオキサホスフェピン
  • 4,6,12,14-テトラ-tert-ブチル-9-{[(1R,2R,3R,5S)-2,6,6-トリメチルビシクロ[3.1.1]ヘプタン-3-イル]オキシ}-8,10-ジオキサ-9-ホスファトリシクロ[9.4.0.02,7]ペンタデカ-1(11),2,4,6,12,14-ヘキサエン
  • 4,6,12,14-tetra-tert-butyl-9-{[(1R,2R,3R,5S)-2,6,6-trimethylbicyclo[3.1.1]heptan-3-yl]oxy}-8,10-dioxa-9-phosphatricyclo[9.4.0.02,7]pentadeca-1(11),2,4,6,12,14-hexaene
Other name (1):
  • 2,4,8,10-Tetra-tert-butyl-6-[[(1α,5α)-2β,6,6-trimethylbicyclo[3.1.1]heptane-3α-yl]oxy]dibenzo[d,f][1,3,2]dioxaphosphepin
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