N-4,n-4-二乙基-2-甲基-1,4-苯二胺结构式
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常用名 | N-4,n-4-二乙基-2-甲基-1,4-苯二胺 | 英文名 | 4-diethylamino-o-toluidine |
|---|---|---|---|---|
| CAS号 | 148-71-0 | 分子量 | 178.27400 | |
| 密度 | 0.995g/cm3 | 沸点 | 300.3ºC at 760mmHg | |
| 分子式 | C11H18N2 | 熔点 | N/A | |
| MSDS | N/A | 闪点 | 122ºC |
| 中文名 | N-4,n-4-二乙基-2-甲基-1,4-苯二胺 |
|---|---|
| 英文名 | N-4,N-4-Diethyl-2-methyl-1,4-benzenediamine |
| 英文别名 | 更多 |
| 密度 | 0.995g/cm3 |
|---|---|
| 沸点 | 300.3ºC at 760mmHg |
| 分子式 | C11H18N2 |
| 分子量 | 178.27400 |
| 闪点 | 122ºC |
| 精确质量 | 178.14700 |
| PSA | 29.26000 |
| LogP | 3.00460 |
| InChIKey | XBTWVJKPQPQTDW-UHFFFAOYSA-N |
| SMILES | CCN(CC)c1ccc(N)c(C)c1 |
| 蒸汽压 | 0.00113mmHg at 25°C |
| 分子结构 | 1、 摩尔折射率:58.89 2、 摩尔体积(cm3/mol):178.9 3、 等张比容(90.2K):452.3 4、 表面张力(dyne/cm):40.7 5、 极化率(10-24cm3):23.34 |
| 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29.3 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 |
| 海关编码 | 2921590090 |
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| 海关编码 | 2921590090 |
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| 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:Cytotoxicity against human WM115 cells assessed as growth inhibition measured after 7...
来源:ChEMBL
靶标:WM-115
External Id:CHEMBL2341091
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实验名称:DNDI: Inhibition of Human African Trypanosomiasis (HAT), STIB 795, in vitro
来源:ChEMBL
靶标:Trypanosoma brucei brucei
External Id:CHEMBL2095144
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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
靶标:N/A
External Id:HMS1303_AS
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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:High-throughput screen for inhibitors of the GIV GBA-motif interaction with Galpha-i ...
来源:ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
靶标:N/A
External Id:HMS1303_FP
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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:Inhibition of human S100B/human TAMRA-p53(367-388) interaction by fluorescence polari...
来源:ChEMBL
靶标:Protein S100-B
External Id:CHEMBL2341094
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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
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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:Alphascreen assay for small molecules abrogating mHTT-CaM Interaction
来源:24983
靶标:Huntingtin
External Id:KUHTS-Muma KU-CaM-Htt INH-01
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| EINECS 205-722-1 |
| 4-N,4-N-diethyl-2-methylbenzene-1,4-diamine |
| N1,N1-Diethyl-3-methylbenzene-1,4-diamine |
| MFCD00137576 |