86632-33-9 ((Phosphine oxide, [1,1'-binaphthalene]-2,2'-diylbis[diphenyl-)

CAS号:
86632-33-9
英文名称:
Phosphine oxide, [1,1'-binaphthalene]-2,2'-diylbis[diphenyl-
分子式:
C44H32O2P2
分子量:
654.671213150024

Phosphine oxide, [1,1'-binaphthalene]-2,2'-diylbis[diphenyl-(86632-33-9)名称与标识符

名称

中文别名:
2,2'-双(二苯基氧膦)-1,1'-联萘;
英文别名:
Phosphine oxide, [1,1'-binaphthalene]-2,2'-diylbis[diphenyl-;PHOSPHINE OXIDE, [1,1'-BINAPHTHALENE]-2,2'-DIYLBIS;(R)-[1,1'-binaphthalene]-2,2'-diylbis(diphenylphosphine oxide);CHEMBL1275992;SEZSRPYCOMAEDL-UHFFFAOYSA-N;(S)-[1,1'-Binaphthalene]-2,2'-diylbis[1,1-diphenyl-1,1'-phosphineoxide];(R)-(+)-2,2'-bis(diphenylphosphinoyl)-1,1'-binaphthyl;BINAPO;E76910;(S)-[1,1'-Binaphthalene]-2,2'-diylbis[1,1-diphenyl-1,1'-phosphine oxide], 98% (99% ee);[1,1''-Binaphthalene]-2,2''-diylbis(diphenylphosphine oxide);(1R)-[1,1'-binaphthalene]-2,2'-diylbis[1,1-diphenyl-1,1'-Phosphine oxide;2,2'-bis(diphenylphosphinyl)-1,1'-binaphthyl;SCHEMBL132989;MFCD00822644;(S)-[1,1'-Binaphthalene]-2,2'-diylbis[1,1-diphenyl-1,1'-phosphine oxide];(R)-[1,1'-Binaphthalene]-2,2'-diylbis[1,1-diphenyl-1,1'-phosphine oxide];94041-16-4;86632-33-9;AT33457;CS-0198444;(R)-[1,1'-Binaphthalene]-2,2'-diylbis[1,1-diphenyl-1,1'-phosphine oxide], 98% (99% ee);94041-18-6;2,2'-bis(diphenylphosphoroso)-1,1'-binaphthalene;CS-0087373;E76909;2-diphenylphosphoryl-1-(2-diphenylphosphorylnaphthalen-1-yl)naphthalene;CS-0087370;[1,1'-binaphthalene]-2,2'-diylbis(diphenylphosphine oxide);rac-2,2'-bis(diphenylphosphinoyl)-1,1'-binaphthyl;(R)-[1,1'-Binaphthalene]-2,2'-diylbis[1,1-diphenyl-1,1'-phosphineoxide];

标识符

InChIKey:
SEZSRPYCOMAEDL-UHFFFAOYSA-N
Inchi:
InChI=1S/C44H32O2P2/c45-47(35-19-5-1-6-20-35,36-21-7-2-8-22-36)41-31-29-33-17-13-15-27-39(33)43(41)44-40-28-16-14-18-34(40)30-32-42(44)48(46,37-23-9-3-10-24-37)38-25-11-4-12-26-38/h1-32H
SMILES:
C1=CC=C(C=C1)P(=O)(C2=CC=CC=C2)C3=C(C4=CC=CC=C4C=C3)C5=C(C=CC6=CC=CC=C65)P(=O)(C7=CC=CC=C7)C8=CC=CC=C8

Phosphine oxide, [1,1'-binaphthalene]-2,2'-diylbis[diphenyl-(86632-33-9)物化性质

实验特性

  • 沸点 : 864.8±65.0 °C(Predicted)
  • 熔点 : 293-295 °C (decomp)
  • 密度 : 1.30±0.1 g/cm3(Predicted)

计算特性

  • 精确分子量 : 654.18775425g/mol
  • 氢键供体数量 : 0
  • 氢键受体数量 : 2
  • 可旋转化学键数量 : 7
  • 同位素质量 : 654.18775425g/mol
  • 重原子数量 : 48
  • 复杂度 : 993
  • 同位素原子数量 : 0
  • 确定原子立构中心数量 : 0
  • 不确定原子立构中心数量 : 0
  • 确定化学键立构中心数量 : 0
  • 不确定化学键立构中心数量 : 0
  • 共价键单元数量 : 1
  • 疏水参数计算参考值(XlogP) : 10.3
  • 拓扑分子极性表面积 : 34.1Ų

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