2-(2,4-二氯苯氧基)乙醇结构式
|
常用名 | 2-(2,4-二氯苯氧基)乙醇 | 英文名 | Ethanol,2-(2,4-dichlorophenoxy) |
|---|---|---|---|---|
| CAS号 | 120-67-2 | 分子量 | 207.05400 | |
| 密度 | N/A | 沸点 | N/A | |
| 分子式 | C8H8Cl2O2 | 熔点 | 54°C | |
| MSDS | N/A | 闪点 | N/A |
| 中文名 | 2-(2,4-二氯苯氧基)乙醇 |
|---|---|
| 英文名 | 2-(2,4-Dichlorophenoxy)ethanol |
| 中文别名 | 2-(2,4-二氯苯氧基)乙醇 |
| 英文别名 | 更多 |
| 熔点 | 54°C |
|---|---|
| 分子式 | C8H8Cl2O2 |
| 分子量 | 207.05400 |
| 精确质量 | 205.99000 |
| PSA | 29.46000 |
| LogP | 2.36450 |
| InChIKey | PCCMNBRZMKANQD-UHFFFAOYSA-N |
| SMILES | OCCOc1ccc(Cl)cc1Cl |
| 分子结构 | 1、 摩尔折射率:48.88 2、 摩尔体积(cm3/mol):151.3 3、 等张比容(90.2K):392.1 4、 表面张力(dyne/cm):45.0 5、 极化率(10-24cm3):19.38 |
| 计算化学 | 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:2 4.可旋转化学键数量:3 5.互变异构体数量:无 6.拓扑分子极性表面积29.5 7.重原子数量:12 8.表面电荷:0 9.复杂度:132 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 |
| 风险声明 (欧洲) | 36/37/38 |
|---|---|
| 安全声明 (欧洲) | S26-S36/37/39 |
| 危险品运输编码 | 2902 |
| 包装等级 | III |
| 危险类别 | 6.1(b) |
| 海关编码 | 2909499000 |
|
~56%
2-(2,4-二氯苯氧基)乙醇 120-67-2 |
| 文献:Morales-Serna, Jose Antonio; Garcia-Rios, Erendira; Bernal, Jorge; Paleo, Ehecatl; Gavino, Ruben; Cardenas, Jorge Synthesis, 2011 , # 9 art. no. M12811SS, p. 1375 - 1382 |
|
~79%
2-(2,4-二氯苯氧基)乙醇 120-67-2 |
| 文献:Yamansarova; Kukovinets; Zainullin; Galin; Kunakova; Zorin; Tolstikov Russian Journal of Organic Chemistry, 2001 , vol. 37, # 2 p. 246 - 255 |
|
~85%
2-(2,4-二氯苯氧基)乙醇 120-67-2 |
| 文献:Yamansarova; Kukovinets; Zainullin; Galin; Kunakova; Zorin; Tolstikov Russian Journal of Organic Chemistry, 2001 , vol. 37, # 2 p. 246 - 255 |
|
~%
2-(2,4-二氯苯氧基)乙醇 120-67-2 |
| 文献:Newman; Fones; Renoll Journal of the American Chemical Society, 1947 , vol. 69, p. 718,721 |
|
~%
2-(2,4-二氯苯氧基)乙醇 120-67-2 |
| 文献:Szajnman, Sergio H.; Yan, Wen; Bailey, Brian N.; Docampo, Roberto; Elhalem, Eleonora; Rodriguez, Juan B. Journal of Medicinal Chemistry, 2000 , vol. 43, # 9 p. 1826 - 1840 |
|
~8%
2-(2,4-二氯苯氧基)乙醇 120-67-2 |
| 文献:Morales-Serna, Jose Antonio; Garcia-Rios, Erendira; Bernal, Jorge; Paleo, Ehecatl; Gavino, Ruben; Cardenas, Jorge Synthesis, 2011 , # 9 art. no. M12811SS, p. 1375 - 1382 |
|
~%
2-(2,4-二氯苯氧基)乙醇 120-67-2 |
| 文献:Dow Chem. Co. Patent: DE929484 , 1952 ; |
|
~%
2-(2,4-二氯苯氧基)乙醇 120-67-2 |
| 文献:Weissenburger Patent: DE882404 , 1951 ; |
|
~%
2-(2,4-二氯苯氧基)乙醇 120-67-2 |
| 文献:Hill et al. Journal of the American Chemical Society, 1959 , vol. 81, p. 3372 |
| 2-(2,4-二氯苯氧基)乙醇上游产品 9 | |
|---|---|
| 2-(2,4-二氯苯氧基)乙醇下游产品 10 | |
| 海关编码 | 2909499000 |
|---|---|
| 中文概述 | 2909499000 其他醚醇及其卤化、磺化、硝化或亚硝化衍生物. 增值税率:17.0% 退税率:9.0% 监管条件:无 最惠国关税:5.5% 普通关税:30.0% |
| 申报要素 | 品名, 成分含量, 用途 |
| Summary | 2909499000. ether-alcohols and their halogenated, sulphonated, nitrated or nitrosated derivatives. VAT:17.0%. Tax rebate rate:9.0%. . MFN tariff:5.5%. General tariff:30.0% |
|
实验名称:Discovery of Small Molecules to Inhibit Human Cytomegalovirus Nuclear Egress
来源:ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
靶标:HCMV UL50
External Id:HMS1262
|
|
实验名称:High-throughput screen for inhibitors of the GIV GBA-motif interaction with Galpha-i ...
来源:ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
External Id:HMS1303
|
|
实验名称:A screen for compounds that inhibit the activity of LtaS in Staphylococcus aureus
来源:ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
External Id:HMS979
|
|
实验名称:Cell-based high throughput primary assay to identify activators of GPR151
来源:The Scripps Research Institute Molecular Screening Center
靶标:RecName: Full=G-protein coupled receptor 151; AltName: Full=G-protein coupled receptor PGR7; AltName: Full=GPCR-2037; AltName: Full=Galanin receptor 4; AltName: Full=Galanin-receptor-like protein; Short=GalRL
External Id:GPR151_PHUNTER_AG_LUMI_1536_1X%ACT
|
|
实验名称:AlphaScreen-based biochemical high throughput primary assay to identify activators of...
来源:The Scripps Research Institute Molecular Screening Center
靶标:N/A
External Id:FBW7_ACT_ALPHA_1536_1X%ACT PRUN
|
|
实验名称:AlphaScreen-based biochemical high throughput primary assay to identify inhibitors of...
来源:The Scripps Research Institute Molecular Screening Center
External Id:MITF_INH_Alpha_1536_1X%INH PRUN
|
| EINECS 204-416-5 |
| 2-(2,4-dichlorophenoxy)ethanol |
| 2-(2,4-dichlorophenoxy)-ethanol |
| MFCD00016564 |