1-(2-羟乙基)-3-苯基硫脲结构式
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常用名 | 1-(2-羟乙基)-3-苯基硫脲 | 英文名 | Thiourea,N-(2-hydroxyethyl)-N'-phenyl |
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| CAS号 | 102-12-5 | 分子量 | 196.26900 | |
| 密度 | 1.281g/cm3 | 沸点 | 332ºC at 760 mmHg | |
| 分子式 | C9H12N2OS | 熔点 | N/A | |
| MSDS | N/A | 闪点 | 154.6ºC |
| 中文名 | 1-(2-羟乙基)-3-苯基硫脲 |
|---|---|
| 英文名 | 1-(2-hydroxyethyl)-3-phenylthiourea |
| 英文别名 | 更多 |
| 密度 | 1.281g/cm3 |
|---|---|
| 沸点 | 332ºC at 760 mmHg |
| 分子式 | C9H12N2OS |
| 分子量 | 196.26900 |
| 闪点 | 154.6ºC |
| 精确质量 | 196.06700 |
| PSA | 76.38000 |
| LogP | 1.42920 |
| InChIKey | MFCXZZJQPDIXAS-UHFFFAOYSA-N |
| SMILES | OCCNC(=S)Nc1ccccc1 |
| 蒸汽压 | 5.97E-05mmHg at 25°C |
| 折射率 | 1.674 |
| 储存条件 | 室温, 密封, 干燥 |
| 分子结构 | 1、 摩尔折射率:57.54 2、 摩尔体积(cm3/mol):153.2 3、 等张比容(90.2K):436.9 4、 表面张力(dyne/cm):66.1 5、 极化率(10-24cm3):22.81 |
| 计算化学 | 1.疏水参数计算参考值(XlogP):无 2.氢键供体数量:3 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:3 6.拓扑分子极性表面积76.4 7.重原子数量:13 8.表面电荷:0 9.复杂度:158 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 |
| 海关编码 | 2930909090 |
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~77%
1-(2-羟乙基)-3-苯基硫脲 102-12-5 |
| 文献:Ramadas; Srinivasan; Janarthanan Tetrahedron Letters, 1993 , vol. 34, # 40 p. 6447 - 6450 |
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~93%
1-(2-羟乙基)-3-苯基硫脲 102-12-5 |
| 文献:Kim, Taek Hyeon; Min, Jung Ki; Lee, Gue-Jae Tetrahedron Letters, 1999 , vol. 40, # 47 p. 8201 - 8204 |
| 1-(2-羟乙基)-3-苯基硫脲上游产品 3 | |
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| 1-(2-羟乙基)-3-苯基硫脲下游产品 3 | |
| 海关编码 | 2930909090 |
|---|---|
| 中文概述 | 2930909090. 其他有机硫化合物. 增值税率:17.0%. 退税率:13.0%. 监管条件:无. 最惠国关税:6.5%. 普通关税:30.0% |
| 申报要素 | 品名, 成分含量, 用途 |
| Summary | 2930909090. other organo-sulphur compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0% |
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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
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实验名称:Screen for inhibitors of RMI FANCM (MM2) intereaction
来源:11908
靶标:N/A
External Id:RMI-FANCM-MM2
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实验名称:Chemical Probes of Kaposi's Sarcoma Herpes Virus Latent Infection
来源:ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
靶标:ORF 73 [Human herpesvirus 8 type M]
External Id:HMS791
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实验名称:Selectivity index, ratio of CC50 for cytotoxicity against LPS-stimulated mouse RAW264...
来源:ChEMBL
靶标:N/A
External Id:CHEMBL5144858
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实验名称:Inhibition of NO production in mouse RAW264.7 cells incubated for 24 hrs by Griess re...
来源:ChEMBL
靶标:RAW264.7
External Id:CHEMBL5144859
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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
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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
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实验名称:Antitubercular activity against Mycobacterium tuberculosis H37Rv assessed as reductio...
来源:ChEMBL
靶标:Mycobacterium tuberculosis
External Id:CHEMBL5144856
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实验名称:A screen for compounds that inhibit viral RNA polymerase binding and polymerization a...
来源:ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
靶标:Chain A, Poliovirus Polymerase With Gtp
External Id:HMS750
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实验名称:Cytotoxicity against LPS-stimulated mouse RAW264.7 cells after 24 hrs by MTT assay
来源:ChEMBL
靶标:RAW264.7
External Id:CHEMBL5144857
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| F0081-0015 |
| 1-(2-hydroxy-ethyl)-3-phenyl-thiourea |
| N-(2-Hydroxy-aethyl)-N'-phenyl-thioharnstoff |
| N-(2-Hydroxyethyl)-N'-phenylthiourea |
| Thiourea,N-(2-hydroxyethyl)-N'-phenyl |
| Urea,1-(2-hydroxyethyl)-3-phenyl-2-thio |
| 1-(2-hydroxyethyl)-3-phenyl-2-thiourea |