2-(3,5-二氯苯基)-1,3-噻唑-4-羧酸乙酯 | 132089-38-4
2-(3,5-二氯苯基)-1,3-噻唑-4-羧酸乙酯
Ethyl 2-(3,5-dichlorophenyl)thiazole-4-carboxylate
132089-38-4
C12H9Cl2NO2S
302.1764
名称和标识符
MDL |
MFCD09743714 |
InChIKey |
HVMLDBROWJVLEG-UHFFFAOYSA-N |
Inchi |
1S/C12H9Cl2NO2S/c1-2-17-12(16)10-6-18-11(15-10)7-3-8(13)5-9(14)4-7/h3-6H,2H2,1H3 |
SMILES |
ClC1C([H])=C(C([H])=C(C=1[H])C1=NC(C(=O)OC([H])([H])C([H])([H])[H])=C([H])S1)Cl |
别名信息
- 中文别名 -
- 2-(3,5-二氯苯基)-1,3-噻唑-4-羧酸乙酯
- 英文别名 -
- Ethyl 2-(3,5-dichlorophenyl)thiazole-4-carboxylate
- 4-Thiazolecarboxylicacid, 2-(3,5-dichlorophenyl)-, ethyl ester
- ethyl 2-(3,5-dichlorophenyl)-1,3-thiazole-4-carboxylate
- ACMC-209zp8
- AGN-PC-00422N
- ANW-50538
- CTK4B7713
- MolPort-003-984-081
- SBB066489
- Ethyl 2-(3,5-dichlorophenyl)
- ethyl 2-(3,5-diMethylphenyl)thiazol-4-carboxylate
- ethyl 2-(3,5-dimethylphenyl)thiazole-4-carboxylate
- IMED1496012952
- AB0035474
- AX8159557
- X9820
- ST24030449
- A806367
- 2-(3,5-dichlorophenyl)-4-thiazolecarboxylic acid ethyl e
- ethyl 2-[3,5-bis(chloranyl)phenyl]-1,3-thiazole-4-carboxylate
- MFCD09743714
- Ethyl 2-(3 pound not5-dichlorophenyl)thiazole-4-carboxylate
- CS-0151685
- 132089-38-4
- 2-(3,5-Dichlorophenyl)thiazole-4-carboxylic acid ethyl ester
- Ethyl2-(3,5-dichlorophenyl)thiazole-4-carboxylate
- FT-0653355
- ETHYL 2-(3,5-DIMETHYL-PHENYL)THIAZOLE-4-CARBOXYLATE
- 4-Thiazolecarboxylic acid, 2-(3,5-dichlorophenyl)-, ethyl ester
- DS-0244
- AKOS015848950
- 2-(3,5-dichlorophenyl)-4-thiazolecarboxylic acid ethyl ester
- DTXSID00569506
- ETHYL 2-(3,5-DICHLOROPHENYL)THIAZOLE-4-CARBOXYLATE
物化性质
实验特性
LogP |
3.60360 |
PSA |
67.43000 |
折射率 |
1.597 |
沸点 |
432.6°C at 760 mmHg |
闪点 |
215.4°C |
密度 |
1.4 |
计算特性
精确分子量 |
261.08200 |
氢键供体数量 |
0 |
氢键受体数量 |
4 |
可旋转化学键数量 |
4 |
同位素质量 |
300.9731051g/mol |
重原子数量 |
18 |
复杂度 |
296 |
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 |
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) |
4.4 |
拓扑分子极性表面积 |
67.4 |
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