(1R,2r)-(+)-n,n'-二甲基-1,2-双[3-(三氟甲基)苯基]乙烯二胺 | 137944-39-9
(1R,2r)-(+)-n,n'-二甲基-1,2-双[3-(三氟甲基)苯基]乙烯二胺
1,2-Ethanediamine,N1,N2-dimethyl-1,2-bis[3-(trifluoromethyl)phenyl]-, (1R,2R)-
137944-39-9
C18H18N2F6
376.33932
名称和标识符
MDL |
MFCD00075560 |
InChIKey |
SBGOGHODWUZHIY-HZPDHXFCSA-N |
Inchi |
InChI=1S/C18H18F6N2/c1-25-15(11-5-3-7-13(9-11)17(19,20)21)16(26-2)12-6-4-8-14(10-12)18(22,23)24/h3-10,15-16,25-26H,1-2H3/t15-,16-/m1/s1 |
SMILES |
CN[C@@H]([C@@H](C1C=CC=C(C(F)(F)F)C=1)NC)C1C=CC=C(C(F)(F)F)C=1 |
别名信息
- 中文别名 -
- (1R,2r)-(+)-n,n′-二甲基-1,2-双[3-(三氟甲基)苯基]乙烯二胺
- 膦-d3
- 柚皮苷二氢查尔酮
- (1R,2R)-(+)-N,N'-二甲基-1,2-双[3-(三氟甲基)苯基]乙二胺
- (1R,2r)-(+)-n,n'-二甲基-1,2-双[3-(三氟甲基)苯基]乙烯二胺
- (1R,2R)-(+)-N,N′-二甲基-1,2-双[(3-三氟甲基)苯基]-1,2-乙二胺
- (1R,2R)-N1,N2-二甲基-1,2-双(3-(三氟甲基)苯基)乙-1,2-二胺
- 英文别名 -
- 1,2-Ethanediamine,N1,N2-dimethyl-1,2-bis[3-(trifluoromethyl)phenyl]-, (1R,2R)-
- (1R,2R)-(+)-N,N′-Dimethyl-1,2-bis[3-(trifluoromethyl)phenyl]ethylenediamine
- (1R,2R)-N,N'-dimethyl-1,2-bis[3-(trifluoromethyl)phenyl]ethane-1,2-diamine
- (1R,2R)-(+)-N,N'-dimethyl-1,2-bis[3-(trifluoromethyl)phenyl]-1,2-ethanediamine
- (1R,2R)-N,N'-dimethyl-1,2-bis(3-trifluoromethylphenyl)-1,2-ethylenediamine
- (1R,2R)-N1,N2-dimethyl-1,2-bis(3-(trifluoromethyl)phenyl)ethane-1,2-diamine
- (R,R)-m-CF3-DMPEDA
- (R,R)-N,N'-Dimethyl-1,2-<bis(m-trifluoromethyl)phenyl>ethylene-1,2-diamine
- (R,R)-N,N'-dimethyl-1,2-bis(3-(trifluoromethyl)phenyl)-1,2-ethanediamine
- AMY25561
- (1R,2R)-(+)-N,N'-Dimethyl-1,2-bis[3-(trifluoromethyl)phenyl]ethanediamine, 97%
- (1R,2R)-(+)-N,N'-Dimethyl-1,2-bis[3-(trifluoromethyl)phenyl]ethylenediamine
- SBGOGHODWUZHIY-HZPDHXFCSA-N
- (1R,2R)-N~1~,N~2~-Dimethyl-1,2-bis[3-(trifluoromethyl)phenyl]ethane-1,2-diamine
- (1R,2R)-(+)-N,N'-DIMETHYL-1,2-BIS[3-(TRIFLUOROMETHYL)PHENYL!-1,2-ETHANE DIAMINE, 99
- 137944-39-9
- SCHEMBL2538654
- BS-53302
- (1R,2R)-(+)-N,N'-Dimethyl-1,2-bis[3-(trifluoromethyl)phenyl]-1,2-ethanediamine
- MFCD00075560
- 1-Chloro-3-di-N-butylaminopropane
- 1,2-Ethanediamine, N1,N2-dimethyl-1,2-bis[3-(trifluoromethyl)phenyl]-, (1R,2R)-
- E82263
- (1R,2R)-(+)-N,N'-Dimethyl-1,2-bis[(3-trifluoromethyl)phenyl]-1,2-ethanediamine
- (1R,2R)-N1,N2-Dimethyl-1,2-bis(3-(trifluoromethyl)phenyl)ethane-1,2-diamine
- J-007080
- CS-0182501
- DTXSID20369323
物化性质
实验特性
LogP |
5.72720 |
PSA |
24.06000 |
熔点 |
112-117 °C |
颜色与性状 |
无可用 |
溶解性 |
无可用 |
光学活性 |
[α]22/D +18.0°, c = 1 in chloroform |
密度 |
1.2608 (estimate) |
计算特性
精确分子量 |
376.13700 |
氢键供体数量 |
2 |
氢键受体数量 |
8 |
可旋转化学键数量 |
5 |
同位素质量 |
376.13741756g/mol |
重原子数量 |
26 |
复杂度 |
396 |
同位素原子数量 |
0 |
确定原子立构中心数量 |
2 |
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) |
4.2 |
互变异构体数量 |
无 |
表面电荷 |
0 |
拓扑分子极性表面积 |
24.1Ų |
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