2-苯氧基吡啶结构式
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常用名 | 2-苯氧基吡啶 | 英文名 | 2-Phenoxypyridine |
|---|---|---|---|---|
| CAS号 | 4783-68-0 | 分子量 | 171.19500 | |
| 密度 | 1.117g/cm3 | 沸点 | 274.4ºC at 760mmHg | |
| 分子式 | C11H9NO | 熔点 | N/A | |
| MSDS | N/A | 闪点 | 100.6ºC |
| 中文名 | 2-苯氧基吡啶 |
|---|---|
| 英文名 | 2-Phenoxypyridine |
| 英文别名 | 更多 |
| 密度 | 1.117g/cm3 |
|---|---|
| 沸点 | 274.4ºC at 760mmHg |
| 分子式 | C11H9NO |
| 分子量 | 171.19500 |
| 闪点 | 100.6ºC |
| 精确质量 | 171.06800 |
| PSA | 22.12000 |
| LogP | 2.87390 |
| InChIKey | MEAAWTRWNWSLPF-UHFFFAOYSA-N |
| SMILES | c1ccc(Oc2ccccn2)cc1 |
| 外观性状 | 固体 |
| 折射率 | 1.577 |
| 储存条件 | 室温, 干燥 |
| 计算化学 | 1.疏水参数计算参考值(XlogP):无 2.氢键供体数量:0 3.氢键受体数量:2 4.可旋转化学键数量:2 5.互变异构体数量:无 6.拓扑分子极性表面积:22.1 7.重原子数量:13 8.表面电荷:0 9.复杂度:143 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 |
| 危害码 (欧洲) | Xi |
|---|---|
| 海关编码 | 2933399090 |
| 2-苯氧基吡啶上游产品 10 | |
|---|---|
| 2-苯氧基吡啶下游产品 5 | |
| 海关编码 | 2933399090 |
|---|---|
| 中文概述 | 2933399090. 其他结构含非稠合吡啶环的化合物. 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:20.0% |
| 申报要素 | 品名, 成分含量, 用途, 乌洛托品请注明外观, 6-己内酰胺请注明外观, 签约日期 |
| Summary | 2933399090. other compounds containing an unfused pyridine ring (whether or not hydrogenated) in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
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来源:The Scripps Research Institute Molecular Screening Center
靶标:mu-type opioid receptor isoform MOR-1 [Homo sapiens]
External Id:OPRM1-OPRD1_AG_LUMI_1536_1X%ACT PRUN
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靶标:disintegrin and metalloproteinase domain-containing protein 17 preproprotein [Homo sapiens]
External Id:ADAM17_INH_QFRET_1536_1X%INH PRUN
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实验名称:Fluorescence-based cell-based primary high throughput screening assay to identify ago...
来源:The Scripps Research Institute Molecular Screening Center
靶标:muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id:CHRM1_AG_FLUO8_1536_1X%ACT PRUN
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实验名称:Retention for passive avoidance learning in mice at dose 20 mg/kg
来源:ChEMBL
靶标:Mus musculus
External Id:CHEMBL727550
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实验名称:Retention for passive avoidance learning in mice at dose 80 mg/kg
来源:ChEMBL
靶标:Mus musculus
External Id:CHEMBL727555
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实验名称:Retention for passive avoidance learning in mice at dose 5.0 mg/kg
来源:ChEMBL
靶标:Mus musculus
External Id:CHEMBL727554
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实验名称:Fluorescence polarization to screen for inhibitor that competite the binding of FadD2...
来源:Broad Institute
靶标:FATTY-ACID-CoA LIGASE FADD28 (FATTY-ACID-CoA SYNTHETASE)
External Id:2147-01_Inhibitor_SinglePoint_HTS_Activity
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实验名称:Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfect...
来源:Broad Institute
靶标:N/A
External Id:Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfected HEK293 cells Inhibition - 7011-01_Antagonist_SinglePoint_HTS_Activity
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实验名称:Fluorescence-based cell-based primary high throughput screening assay to identify pos...
来源:The Scripps Research Institute Molecular Screening Center
靶标:muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id:CHRM1_PAM_FLUO8_1536_1X%ACT PRUN
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实验名称:Fluorescence polarization-based biochemical high throughput primary assay to identify...
来源:The Scripps Research Institute Molecular Screening Center
靶标:RecName: Full=Sialate O-acetylesterase; AltName: Full=H-Lse; AltName: Full=Sialic acid-specific 9-O-acetylesterase; Flags: Precursor [Homo sapiens]
External Id:SIAE_INH_FP_1536_1X%INH PRUN
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| 2-phenoxypyridine |