N,N'-二邻甲苯基乙二胺结构式
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常用名 | N,N'-二邻甲苯基乙二胺 | 英文名 | N,N'-ethylenedi-o-toluidine |
|---|---|---|---|---|
| CAS号 | 94-92-8 | 分子量 | 240.34300 | |
| 密度 | 1.083g/cm3 | 沸点 | 434.2ºC at 760mmHg | |
| 分子式 | C16H20N2 | 熔点 | 70-73ºC | |
| MSDS | N/A | 闪点 | 277.4ºC |
| 中文名 | N,N’-二邻甲苯基乙二胺 |
|---|---|
| 英文名 | N,N'-bis(2-methylphenyl)ethane-1,2-diamine |
| 中文别名 | N,N'-二邻甲苯基乙二胺 |
| 英文别名 | 更多 |
| 密度 | 1.083g/cm3 |
|---|---|
| 沸点 | 434.2ºC at 760mmHg |
| 熔点 | 70-73ºC |
| 分子式 | C16H20N2 |
| 分子量 | 240.34300 |
| 闪点 | 277.4ºC |
| 精确质量 | 240.16300 |
| PSA | 24.06000 |
| LogP | 3.97340 |
| InChIKey | ZQMPWXFHAUDENN-UHFFFAOYSA-N |
| SMILES | Cc1ccccc1NCCNc1ccccc1C |
| 折射率 | 1.634 |
| 储存条件 | 密封于阴凉、干燥处保存。确保工作间有良好的通风设施。远离火源,储存的地方远离氧化剂。 |
| 稳定性 | 避免与氧化物接触。 |
| 分子结构 | 1、 摩尔折射率:79.32 2、 摩尔体积(cm3/mol):221.7 3、 等张比容(90.2K):575.4 4、 表面张力(dyne/cm):45.3 5、 极化率(10-24cm3):31.44 |
| 计算化学 | 1.疏水参数计算参考值(XlogP):4.3 2.氢键供体数量:2 3.氢键受体数量:2 4.可旋转化学键数量:5 5.互变异构体数量:无 6.拓扑分子极性表面积24.1 7.重原子数量:18 8.表面电荷:0 9.复杂度:205 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 |
| 更多 | 1. 性状:粉末 2. 密度(g/mL,20℃):未确定 3. 相对蒸汽密度(g/mL,空气=1):未确定 4. 熔点(ºC):70-73 5. 沸点(ºC,常压):未确定 6. 沸点(ºC,mmHg):未确定 7. 折射率:未确定 8. 闪点(ºC):未确定 9. 比旋光度(º):未确定 10. 自燃点或引燃温度(ºC):未确定 11. 蒸气压(mmHg,ºC):未确定 12. 饱和蒸气压(kPa, ºC):未确定 13. 燃烧热(KJ/mol):未确定 14. 临界温度(ºC):未确定 15. 临界压力(KPa):未确定 16. 油水(辛醇/水)分配系数的对数值:未确定 17. 爆炸上限(%,V/V):未确定 18. 爆炸下限(%,V/V):未确定 19. 溶解性:未确定 |
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N,N'-二邻甲苯基乙二胺 94-92-8 |
| 文献:Bischoff; Nastvogel Chemische Berichte, 1890 , vol. 23, p. 2026 |
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N,N'-二邻甲苯基乙二胺 94-92-8 |
| 文献:Wucher, Philipp; Roesle, Philipp; Falivene, Laura; Cavallo, Luigi; Caporaso, Lucia; Goettker-Schnetmann, Inigo; Mecking, Stefan Organometallics, 2012 , vol. 31, # 24 p. 8505 - 8515 |
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N,N'-二邻甲苯基乙二胺 94-92-8 |
| 文献:Buckley, Benjamin R.; Neary, Stephen P. Tetrahedron, 2010 , vol. 66, # 40 p. 7988 - 7994 |
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N,N'-二邻甲苯基乙二胺 94-92-8 |
| 文献:Bischoff; Hausdoerfer Chemische Berichte, 1890 , vol. 23, p. 1998 Chemische Berichte, 1892 , vol. 25, p. 2284,2287 |
| 海关编码 | 2921590090 |
|---|---|
| 中文概述 | 2921590090. 其他芳香多胺及衍生物及它们的盐. 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 | 2921590090. other aromatic polyamines and their derivatives; salts thereof. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0% |
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实验名称:Primary cell-based high-throughput screening assay for identification of compounds th...
来源:Johns Hopkins Ion Channel Center
靶标:regulator of G-protein signaling 4 isoform 2 [Homo sapiens]
External Id:JHICC_RGS_Act_HTS
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实验名称:Luminescence-based cell-based primary high throughput screening assay to identify ago...
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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实验名称:QFRET-based biochemical primary high throughput screening assay to identify exosite i...
来源:The Scripps Research Institute Molecular Screening Center
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:uHTS identification of small molecule activators of the adaptive arm of the Unfolded ...
来源:Burnham Center for Chemical Genomics
靶标:N/A
External Id:BCCG-A405-UPR-XBP1-PrimaryAgonist-Assay
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实验名称:High throughput fluorescence intensity-based biochemical assay to screen for small mo...
来源:University of Pittsburgh Molecular Library Screening Center
靶标:furin (paired basic amino acid cleaving enzyme), isoform CRA_a [Homo sapiens]
External Id:MH080376 Biochemical HTS for Inhibitors of the Proprotein Convertase Furin.
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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: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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实验名称:Absorbance-based primary biochemical high throughput screening assay to identify acti...
来源:The Scripps Research Institute Molecular Screening Center
靶标:caspase-3 preproprotein [Homo sapiens]
External Id:PROCASPASE3_ACT_EPIABS_1536_1X%ACT PRUN
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| N,N'-ethylenedi-o-toluidine |
| MFCD00048073 |
| N,N'-Di-o-tolyl-aethylendiamin |
| N,N'-Di-o-tolyl-ethylendiamin |
| EINECS 202-375-8 |