顺式-(1R,3R)-1,2,3,4-四氢-1-(3,4-亚甲二氧基苯基)-9H-吡啶并[3,4-B]吲哚-3-羧酸甲酯他达那非中间体 | 15409-60-6
顺式-(1R,3R)-1,2,3,4-四氢-1-(3,4-亚甲二氧基苯基)-9H-吡啶并[3,4-B]吲哚-3-羧酸甲酯他达那非中间体
2-[(dimethylamino)methyl]cyclohexanone
15409-60-6
C9H17NO
155.2374
名称和标识符
MDL |
MFCD00019457 |
InChIKey |
QDHLEFBSGUGHCL-UHFFFAOYSA-N |
Inchi |
1S/C9H17NO/c1-10(2)7-8-5-3-4-6-9(8)11/h8H,3-7H2,1-2H3 |
SMILES |
O=C1C([H])([H])C([H])([H])C([H])([H])C([H])([H])C1([H])C([H])([H])N(C([H])([H])[H])C([H])([H])[H] |
别名信息
- 中文别名 -
- 2-(N,N-二甲基氨基甲基)环己酮
- 2-[(二甲基氨基)甲基]-环己烷
- 2-二甲氨基甲基环己酮
- 波生坦中间体(II)
- 顺式-(1R,3R)-1,2,3,4-四氢-1-(3,4-亚甲二氧基苯基)-9H-吡啶并[3,4-B]吲哚-3-羧酸甲酯他达那非中间体
- 英文别名 -
- 2-((Dimethylamino)methyl)cyclohexanone
- 2-[(dimethylamino)methyl]cyclohexan-1-one
- 2-(Bismethyl)aminomethylcyclohexanone
- 2-[(Dimethylamino)methyl]cyclohexanone
- 2-DIMETHYLAMINOMETHYL-CYCLOHEXANONE
- Cyclohexanone, 2- [(dimethylamino)methyl]-
- 2-(N,N-Dimethylaminomethyl)cyclohexanone
- 2-(Dimethylamino)methylcyclohexanone
- 2-((DIMETHYLAMINO)METHYL)CYCLOHEXANONE(WXG01629)
- 2-[(N,N-DIMETHYLAMINO)METHYL]-CYCLOHEXANONE HYDROCHLORIDE
- Cyclohexanone, 2-[(dimethylamino)methyl]-
- 2-Dimethylamino methyl cyclohexanone
- Cyclohexanone,2-[(dimethylamino)methyl]-
- 2-((Dimethylamino)methyl)cyclohexan-1-one
- 2-dimethylaminomethylcyclohexanone
- QDHLEFBSGUGHCL-UHFFFAOYSA-N
- 2-Dimethylaminomethyl-cyclohexanone hydrochloride
- 2-[(dimethylamino)methyl]cyclohexanone
- (2rs)-2-((dimethylamino)methyl)cyclohexanone
- TRAMADOL HYDROCHLORIDE IMPURITY E [EP IMPURITY]
- HMS1410D07
- 2-(Dimethylaminomethyl)cyclohexanone
- MFCD00019457
- 2-(dimethylaminomethyl)-1-cyclohexanone
- FT-0663396
- BB 0218340
- 2K361MJ2WZ
- EINECS 239-422-7
- NSC222825
- AB93244
- AMY23638
- AKOS016050357
- A883753
- 2-(dimethylaminomethyl)-cyclohexanone
- 2-((Dimethylamino)methyl)cyclohexanone, (2RS)-
- DTXSID801283556
- 2-Dimethylamino methylcyclohexanone
- SR-01000390594
- Enamine_005705
- AS-40797
- Q27254848
- (+/-) 2-((dimethylamino)methyl) cyclohexanone
- NS00011448
- SR-01000390594-1
- (+/-) 2-((dimethylamino)methyl)cyclohexanone
- CHEMBL1617601
- NCGC00246455-01
- 15409-60-6
- SY240044
- SCHEMBL3146259
- NSC 222825
- EN300-1255769
- NSC-222825
- AKOS001015415
- (+/-)-2-((dimethylamino)methyl)cyclohexanone
- Z56770961
- CS-0151293
- Cyclohexanone, 2-((dimethylamino)methyl)-
- UNII-2K361MJ2WZ
- Tramadol impurity E
- IDI1_007940
- 2-Dimethylaminomethyl-cyclohexanone
- N,N-dimethylaminomethylcyclohexanone
- 2-(BisMethyl)aMinoMethylcyclohexanone
- Cyclohexanone,2-[(diMethylaMino)Methyl]-
物化性质
实验特性
PSA |
17.82 |
折射率 |
1.4672 |
沸点 |
222 ºC |
闪点 |
70 ºC |
密度 |
0.944 |
计算特性
精确分子量 |
159.96365 |
氢键供体数量 |
0 |
氢键受体数量 |
2 |
可旋转化学键数量 |
2 |
同位素质量 |
155.131014166g/mol |
重原子数量 |
11 |
复杂度 |
143 |
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 |
1 |
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) |
1 |
拓扑分子极性表面积 |
20.3 |
顺式-(1R,3R)-1,2,3,4-四氢-1-(3,4-亚甲二氧基苯基)-9H-吡啶并[3,4-B]吲哚-3-羧酸甲酯他达那非中间体推荐生产厂家