N-(2,5-二甲氧基苯基)-2-羟基二苯并呋喃-3-甲酰胺结构式
|
常用名 | N-(2,5-二甲氧基苯基)-2-羟基二苯并呋喃-3-甲酰胺 | 英文名 | N-(2,5-Dimethoxyphenyl)-2-hydroxydibenzofuran-3-carboxamide |
|---|---|---|---|---|
| CAS号 | 132-62-7 | 分子量 | 363.36300 | |
| 密度 | 1.367g/cm3 | 沸点 | 503.9ºC at 760mmHg | |
| 分子式 | C21H17NO5 | 熔点 | N/A | |
| MSDS | N/A | 闪点 | 258.5ºC |
用途主要用作棉、粘胶织物染色和印花的打底剂。 |
| 中文名 | 色酚AS-BT |
|---|---|
| 英文名 | N-(2,5-Dimethoxyphenyl)-2-hydroxydibenzofuran-3-carboxamide |
| 中文别名 | 冰染偶合组分 16 | N-(2,5-二甲氧基苯基)-2-羟基二苯并呋喃-3-甲酰胺 | 纳夫妥 AS-BT | C.I.冰染偶和组分 16 |
| 英文别名 | 更多 |
| 密度 | 1.367g/cm3 |
|---|---|
| 沸点 | 503.9ºC at 760mmHg |
| 分子式 | C21H17NO5 |
| 分子量 | 363.36300 |
| 闪点 | 258.5ºC |
| 精确质量 | 363.11100 |
| PSA | 80.93000 |
| LogP | 4.63410 |
| InChIKey | IWWAOEHIGYWDRA-UHFFFAOYSA-N |
| SMILES | COc1ccc(OC)c(NC(=O)c2cc3oc4ccccc4c3cc2O)c1 |
| 蒸汽压 | 8.91E-11mmHg at 25°C |
| 折射率 | 1.711 |
| 分子结构 | 1、 摩尔折射率:97.72 2、 摩尔体积(cm3/mol):225.2 3、 等张比容(90.2K):665.0 4、 表面张力(dyne/cm):76.0 5、 极化率(10-24cm3):38.74 |
| 计算化学 | 1.疏水参数计算参考值(XlogP):4.6 2.氢键供体数量:2 3.氢键受体数量:5 4.可旋转化学键数量:4 5.互变异构体数量:7 6.拓扑分子极性表面积80.9 7.重原子数量:27 8.表面电荷:0 9.复杂度:529 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.外观与性状:灰白色粉末。 2熔点(℃):217。 3.溶解性:可溶于吡啶,不溶于水和碳酸钠溶液,在硫酸中呈黄色,在氢氧化钠溶液中也呈黄色。 |
| 海关编码 | 2932999099 |
|---|
|
~%
N-(2,5-二甲氧基苯基)-... 132-62-7 |
| 文献:DE607381 , ; Fortschr. Teerfarbenfabr. Verw. Industriezweige, vol. 21, p. 275 |
| 上游产品 2 | |
|---|---|
| 下游产品 0 | |
以邻氯苯胺、对苯二醌和2,5-二甲氧基苯胺为主体原料。经邻氯苯胺重氮化后,与对苯二醌缩合,再用保险粉还原,通过氢氧化钾的作用进行闭环,利用二氧碳进行羧基化,再在三氯化磷参与下,与2,5-二甲氧基苯胺进行缩合,而后用碳酸钠中和、蒸出氯苯,最后过滤、干燥而得成品。
| 海关编码 | 2932999099 |
|---|---|
| 中文概述 | 2932999099. 其他仅含氧杂原子的杂环化合物. 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 |
| Summary | 2932999099. other heterocyclic compounds with oxygen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
|
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
|
|
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
|
|
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
|
|
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
|
|
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
|
|
实验名称:Antibacterial activity against Klebsiella pneumoniae MDR ATCC 70063 (CO-ADD:GN_003); ...
来源:ChEMBL
靶标:Klebsiella pneumoniae
External Id:CHEMBL4296186
|
|
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.
|
|
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
|
|
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
|
|
实验名称:Identifying Sarm1 TIR NADase inhibitors through high throughput HPLC assay
来源:24386
靶标:N/A
External Id:Sarm1 TIR NADase inhibitors
|
| 2-hydroxy-dibenzofuran-3-carboxylic acid-(2,5-dimethoxy-anilide) |
| Naphthol AS-DB |
| 2-Hydroxy-dibenzofuran-3-carbonsaeure-(2,5-dimethoxy-anilid) |
| Naphtanilide BT |
| 2-hydroxy-2',5'-dimethoxydibenzofuran-3-carboxanilide |
| Naphthanil DB |
| C.I. Azoic Coupling Component 16 |
| 3-Dibenzofurancarboxamide,N-(2,5-dimethoxyphenyl)-2-hydroxy |
| EINECS 205-069-2 |
| Naphthol AS-BT |