四-(4-甲基苯基)硼烷-四苯苛磷酸复合物 | 181259-35-8
四-(4-甲基苯基)硼烷-四苯苛磷酸复合物
Tetraphenylphosphonium Tetra-p-tolylborate
181259-35-8
C52H48BP
714.7223
名称和标识符
MDL |
MFCD08274957 |
InChIKey |
FAYPBNFHFCEUQZ-UHFFFAOYSA-N |
Inchi |
1S/C28H28B.C24H20P/c1-21-5-13-25(14-6-21)29(26-15-7-22(2)8-16-26,27-17-9-23(3)10-18-27)28-19-11-24(4)12-20-28;1-5-13-21(14-6-1)25(22-15-7-2-8-16-22,23-17-9-3-10-18-23)24-19-11-4-12-20-24/h5-20H,1-4H3;1-20H/q-1;+1 |
SMILES |
[P+](C1C([H])=C([H])C([H])=C([H])C=1[H])(C1C([H])=C([H])C([H])=C([H])C=1[H])(C1C([H])=C([H])C([H])=C([H])C=1[H])C1C([H])=C([H])C([H])=C([H])C=1[H].C1([B-](C2C([H])=C([H])C(C([H])([H])[H])=C([H])C=2[H])(C2C([H])=C([H])C(C([H])([H])[H])=C([H])C=2[H])C2C([H])=C([H])C(C([H])([H])[H])=C([H])C=2[H])C([H])=C([H])C(C([H])([H])[H])=C([H])C=1[H] |
别名信息
- 中文别名 -
- 四对甲苯基硼化四苯基膦
- Tetraphenylphosphonium Tetra-p-tolylborate 四对甲苯基硼化四苯基膦
- 硫代乙酸丙酯
- 四-(4-甲基苯基)硼烷-四苯苛磷酸复合物
- 英文别名 -
- Tetraphenylphosphonium tetra-p-tolylborate
- 2-Deoxysepiapterin
- Tetrakis(4-methylphenyl)borane-Tetraphenylphosphin e Complex
- tetrakis(4-methylphenyl)boranuide,tetraphenylphosphanium
- T2603
- TETRAKIS(4-METHYLPHENYL)BORANE-TETRAPHENYLPHOSPHINE COMPLEX
- Tetraphenylphosphanium tetrakis(4-methylphenyl)borate(1-)
- TeTraphenylphosphonium TeTra-p-TolylboraTe
- Tetraphenylphosphonium Tetra-p-tolylborate
- SCHEMBL503790
- 181259-35-8
- AKOS015911603
- D92624
- tetrakis(4-methylphenyl)boranuide
- tetraphenylphosphanium
- J-011578
- DTXSID40630289
- MFCD08274957
物化性质
实验特性
LogP |
8.60360 |
PSA |
13.59000 |
计算特性
精确分子量 |
714.35900 |
氢键供体数量 |
0 |
氢键受体数量 |
1 |
可旋转化学键数量 |
8 |
同位素质量 |
714.359 |
重原子数量 |
54 |
复杂度 |
688 |
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 |
2 |
疏水参数计算参考值(XlogP) |
无 |
互变异构体数量 |
无 |
表面电荷 |
0 |
拓扑分子极性表面积 |
0 |