2,6-二甲基-4-羟基苯甲基胺
- 中文名称:
- 2,6-二甲基-4-羟基苯甲基胺
- 中文别名:
- 2,6-二甲基-4-羟基苯甲基胺;
4-[(1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthren-1-yl)methyl-(3-oxo-3-phenylpropyl)amino]butan-2-one,hydrochloride
- 英文名称:
- 2-Butanone,4-[[[(1R,4aS,10aR)-1,2,3,4,4a,9,10,10a-octahydro-1,4a-dimethyl-7-(1-methylethyl)-1-phenanthrenyl]methyl](3-oxo-3-phenylpropyl)amino]-,hydrochloride (1:1)
- 英文别名:
- 4-[(1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthren-1-yl)methyl-(3-oxo-3-phenylpropyl)amino]butan-2-one,hydrochloride;
2-Butanone, 4-(1R,4aS,10aR)-1,2,3,4,4a,9,10,10a-octahydro-1,4a-dimethyl-7-(1-methylethyl)-1-phenanthrenylmethyl(3-oxo-3-phenylpropyl)amino-, hydrochloride;
2-Butanone, 4-[[[1,2,3,4,4a,9,10,10a- octahydro-1,4a-dimethyl-7-(1-methylethyl)-1-phenanthrenyl ]methyl](3-oxo-3-phenylpropyl)amino]-, hydrochloride, [1R-(1α,4aα)]-;
2-Butanone, 4-((((1R,4as,10ar)-1,2,3,4,4A,9,10,10A-octahydro-1,4A-dimethyl-7-(1-methylethyl)-1-phenanthrenyl)methyl)(3-oxo-3-phenylpropyl)amino)-, hydrochloride (1:1);
2-Butanone, 4-(((1,2,3,4,4A,9,10,10A-octahydro-1,4A-dimethyl-7-(1-methylethyl)-1-phenanthrenyl)methyl)(3-oxo-3-phenylpropyl)amino)-, hydrochloride, (1R-(1alpha,4abeta,10aalpha))-
- CAS No.:
- 143106-84-7
- 分 子 式:
-
C33H45NO2.ClH
- 分 子 量:
- 0
- 精确分子量:
- 523.32200
- PSA:
- 37.38000
- 分子结构式:
-

- SDS:
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2,6-二甲基-4-羟基苯甲基胺 物化性质
- 沸点:
- 600ºC at 760mmHg
- 闪点:
- 221.3ºC
- 蒸汽压:
- 2.35E-14mmHg at 25°C
2,6-二甲基-4-羟基苯甲基胺 分子结构与计算化学数据
计算化学数据
1.疏水参数计算参考值(XlogP):无
2.氢键供体数量:1
3.氢键受体数量:3
4.可旋转化学键数量:10
5.互变异构体数量:6
6.拓扑分子极性表面积:37.4
7.重原子数量:37
8.表面电荷:0
9.复杂度:755
10.同位素原子数量:0
11.确定原子立构中心数量:0
12.不确定原子立构中心数量:3
13.确定化学键立构中心数量:0
14.不确定化学键立构中心数量:0
15.共价键单元数量:2