1-[[2-(4-chlorophenyl)-4,4-dimethyl-1-cyclohexen-1-yl]methyl]Piperazine | 1228780-72-0
1-[[2-(4-chlorophenyl)-4,4-dimethyl-1-cyclohexen-1-yl]methyl]Piperazine
1-((4'-Chloro-5,5-dimethyl-3,4,5,6-tetrahydro-1,1'-biphenyl-2-yl)methyl)piperazine
1228780-72-0
C19H27ClN2
318.8841
名称和标识符
MDL |
MFCD28334264 |
InChIKey |
YCNNHDUZLQPKJY-UHFFFAOYSA-N |
Inchi |
1S/C19H27ClN2/c1-19(2)8-7-16(14-22-11-9-21-10-12-22)18(13-19)15-3-5-17(20)6-4-15/h3-6,21H,7-14H2,1-2H3 |
SMILES |
ClC1C([H])=C([H])C(=C([H])C=1[H])C1=C(C([H])([H])N2C([H])([H])C([H])([H])N([H])C([H])([H])C2([H])[H])C([H])([H])C([H])([H])C(C([H])([H])[H])(C([H])([H])[H])C1([H])[H] |
别名信息
- 中文别名 -
- 1-((4'-氯-5,5-二甲基-3,4,5,6-四氢-[1,1'-联苯]-2-基)甲基)哌嗪
- 1-[[2-(4-氯苯基)-4,4-二甲基-1-环己烯-1-基]甲基]哌嗪
- 1-[[2-(4-氯苯基)-4,4-二甲基环己-1-烯基]甲基]哌嗪
- 4-((2-(4-氯苯基)-4,4-二甲基-1-环己烯)甲基)哌嗪
- ABT199中间体
- ABT-199中间体
- 对羟基苯甲酸乙酯
- 1-[[2-(4-氯苯基)-4,4-二甲基环己-1-烯基]甲基]
- 1-[[2-(4-chlorophenyl)-4,4-dimethyl-1-cyclohexen-1-yl]methyl]Piperazine
- 英文别名 -
- 1-[[2-(4-chlorophenyl)-4,4-dimethyl-1-cyclohexen-1-yl]methyl]Piperazine
- 1-((2-(4-chlorophenyl)-4,4-dimethylcyclohex-1-enyl)methyl)piperazine
- 1-((4'-chloro-5,5-dimethyl-3,4,5,6-tetrahydro-[1,1'-biphenyl]-2-yl)methyl)piperazine
- AK186852
- 1-[[2-(4-Chlorophenyl)-4,4-dimethylcyclohex-1-enyl]methyl]piperazine
- 1-{[2-(4-chlorophenyl)-4,4-dimethylcyclohex-1-en-1-yl]methyl}piperazine
- Piperazine, 1-[[2-(4-chlorophenyl)-4,4-dimethyl-1-cyclohexen-1-yl]methyl]-
- BCP28860
- SB17748
- DS
物化性质
实验特性
沸点 |
421.2±45.0°C at 760 mmHg |
溶解度 |
Very 微溶 (0.24 g/L) (25 ºC), |
密度 |
1.072±0.06 g/cm3 (20 ºC 760 Torr), |
计算特性
氢键供体数量 |
1 |
氢键受体数量 |
2 |
可旋转化学键数量 |
3 |
重原子数量 |
22 |
复杂度 |
402 |
拓扑分子极性表面积 |
15.3 |
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