4,6-二甲基-2-甲磺酰基嘧啶

4,6-二甲基-2-甲磺酰基嘧啶 基本信息
CAS号 35144-22-0 分子式 C7H10N2O2S
分子量 186.2315 精确质量  N/A
PSA  N/A LogP  N/A

基本信息 展开↓

CAS号:
35144-22-0
3D弹球模型:
立即前往扯扯看
分子式:
C7H10N2O2S
分子量:
186.2315
中文名称:
4,6-二甲基-2-甲磺酰基嘧啶
英文名称:
4,6-Dimethyl-2-(methylsulfonyl)pyrimidine
中文别名:
4,6-二甲基-2-甲磺酰基嘧啶;
2-甲磺酰基-4,6-二甲基嘧啶;
(3-trimethoxysilylpropyl)diethylenetriamine;
N-(2-aminoethyl)-N'-[3-(trimethoxysilyl)propyl]ethane-1,2-diamine;
3-[2-(2-Aminoethylamino)ethylamino]propyl-trimethoxysilane;
N-[3-(Trimethoxysilyl)-propyl]-diethylenetriamine;
Diethylenetriaminopropyltrimethoxysilane;
Trimethoxysilyl Propyl Diethylenetriamine;
Bis(1,5-cyclooctadiene)rhodium(I)tetrafluoroborate Also available as trifluoromethanesulfonate and hexafluorophosphate;
Bis(1,5-Cyclooctadiene) Rhodium(I) Tetrafluoroborate;
Bis(1,5-cyclooctadiene)rhodium(I) tetrafluoroborate;
L-硫代脯氨酸;
4-(1-methylpiperidin-4-ylidene)-4,9-dihydro-10H-benzo[4,5]cyclohepta[1,2-b]thiophen-10-one (2E)-but-2-enedioate;
ketotifen fumarate;
Ketotifen;
Maalox Antidiarrheal;
PJ185;
R 18553;
Suprasec;
Tebloc;
UNII-77TI35393C;
Up and up anti diarrheal;
1-Piperidinebutanamide, 4-(4-chlorophenyl)-4-hydroxy-N,N-dimethyl-alpha,alpha-diphenyl-, hydrochloride;
1-Piperidinebutanamide, 4-(4-chlorophenyl)-4-hydroxy-N,N-dimethyl-alpha,alpha-diphenyl-, monohydrochloride;
4-(4-Chloroph
英文别名:
4,6-Dimethyl-2-(methylsulfonyl)pyrimidine;
4,6-Dimethyl-2-methylsulfonyl pyrimidine;
2-Methanesulfonyl-4,6-Dimethyl-Pyrimidine;
Ambrisentan Intermediate-1;
4,6-dimethyl-2-(methylsulfonyl)pyrimidine;
4,6-dimethyl-2-methylsulfonylpyrimidine;
N-[3-(Trimethoxysilyl)-propyl]-diethylenetriamine;
Diethylenetriaminopropyltrimethoxysilane;
Trimethoxysilyl Propyl Diethylenetriamine;
Bis(1,5-cyclooctadiene)rhodium(I)tetrafluoroborate Also available as trifluoromethanesulfonate and hexafluorophosphate;
Bis(1,5-Cyclooctadiene) Rhodium(I) Tetrafluoroborate;
Bis(1,5-cyclooctadiene)rhodium(I) tetrafluoroborate;
L-硫代脯氨酸;
4-(1-methylpiperidin-4-ylidene)-4,9-dihydro-10H-benzo[4,5]cyclohepta[1,2-b]thiophen-10-one (2E)-but-2-enedioate;
ketotifen fumarate;
Ketotifen;
Maalox Antidiarrheal;
PJ185;
R 18553;
Suprasec;
Tebloc;
UNII-77TI35393C;
Up and up anti diarrheal;
1-Piperidinebutanamide, 4-(4-chlorophenyl)-4-hydroxy-N,N-dimethyl-alpha,alpha-diphenyl-, hydrochloride;
1-Piperidinebutanamide, 4-(4-chlorophenyl)-4-hydroxy-N,N-dimethyl-alpha,alpha-diphenyl-, monohydrochloride;
4-(4-Chlorophenyl)-4-hyd
贝尔斯坦号/MDL:
MFCD03788286
InChI:
InChI=1/C7H10N2O2S/c1-5-4-6(2)9-7(8-5)12(3,10)11/h4H,1-3H3

物化性质展开↓

密度:
1.239g/cm3
熔点:
84-86℃
沸点:
358.3°C at 760 mmHg
闪点:
170.5°C
其它信息:

1.   熔点(ºC):84~86

2..密度:1.239

分子结构与计算化学数据展开↓

分子结构数据


1、 摩尔折射率:45.04

2、 摩尔体积(cm3/mol):150.2

3、 等张比容(90.2K):390.9

4、 表面张力(dyne/cm):45.8

5、 极化率(10-24cm3):17.85

计算化学数据


1.疏水参数计算参考值(XlogP):0.6

2.氢键供体数量:0

3.氢键受体数量:4

4.可旋转化学键数量:1

5.互变异构体数量:无

6.拓扑分子极性表面积68.3

7.重原子数量:12

8.表面电荷:0

9.复杂度:235

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:0

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:1

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