2-(1,3-二氧代异吲哚啉-2-基氧基)乙酸甲酯结构式
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常用名 | 2-(1,3-二氧代异吲哚啉-2-基氧基)乙酸甲酯 | 英文名 | methyl 2-(1,3-dioxoisoindol-2-yl)oxyacetate |
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| CAS号 | 80733-98-8 | 分子量 | 235.19300 | |
| 密度 | N/A | 沸点 | N/A | |
| 分子式 | C11H9NO5 | 熔点 | N/A | |
| MSDS | N/A | 闪点 | N/A |
本表展示该化学物质的中文名称、英文系统名、各类中文与英文别名信息。
| 中文名 | 2-(1,3-二氧代异吲哚啉-2-基氧基)乙酸甲酯 |
|---|---|
| 英文名 | methyl 2-(1,3-dioxoisoindol-2-yl)oxyacetate |
| 英文别名 | 更多 |
本表包含该物质理化参数,如熔点、沸点、密度、溶解度、旋光性等理化指标,无数据项标记为N/A。
| 分子式 | C11H9NO5 |
|---|---|
| 分子量 | 235.19300 |
| 精确质量 | 235.04800 |
| PSA | 72.91000 |
| LogP | 0.32510 |
| InChIKey | MSKBUVDLWGTLAC-UHFFFAOYSA-N |
| SMILES | COC(=O)CON1C(=O)c2ccccc2C1=O |
本表提供该化合物公开报道的合成路线、反应条件、反应物与产物参考信息。
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~83%
2-(1,3-二氧代异吲哚啉-... 80733-98-8 |
| 文献:Sheppard, Andrew; Miller, Marvin J. Journal of the Chemical Society, Perkin Transactions 1: Organic and Bio-Organic Chemistry (1972-1999), 1990 , # 9 p. 2519 - 2525 |
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~70%
2-(1,3-二氧代异吲哚啉-... 80733-98-8 |
| 文献:Edafiogho, Ivan O.; Scott, K. R.; Moore, Jacqueline A.; Farrar, Vida A.; Nicholson, Jesse M. Journal of Medicinal Chemistry, 1991 , vol. 34, # 1 p. 387 - 392 |
本表列出该化学品对应的上游起始原料以及下游衍生产物清单。
| 2-(1,3-二氧代异吲哚啉-2-基氧基)乙酸甲酯上游产品 3 | |
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| 2-(1,3-二氧代异吲哚啉-2-基氧基)乙酸甲酯下游产品 0 | |
本表记录该化合物靶点、体外体内实验、生物测定实验相关实验数据。
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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: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: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: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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本表罗列该化合物全部英文别名、系统命名、CAS别名等英文名称集合。
| methyl [(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)oxy]acetate |
| [(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)oxy]-acetic acid,methyl ester |
| methyl 2-(1,3-dioxoisoindolin-2-yloxy)acetate |
| Methyl phthalimido-oxyactate |
| N-methoxycarbonylmethyloxyphthalimide |
| (1,3-Dioxo-1,3-dihydro-isoindol-2-yloxy)-acetic acid methyl ester |
| methyl (phthalimidooxy)acetate |
| HMS1608N03 |
本部分为该化合物相关常见问答,包含基础参数、性状、储存条件等高频咨询问题与对应答案。
| Q: 2-(1,3-二氧代异吲哚啉-2-基氧基)乙酸甲酯的英文名称是什么? |
| A: 2-(1,3-二氧代异吲哚啉-2-基氧基)乙酸甲酯英文名称为methyl 2-(1,3-dioxoisoindol-2-yl)oxyacetate。 |
| Q: 80733-98-8的中文名称是什么? |
| A: 80733-98-8的中文名称为2-(1,3-二氧代异吲哚啉-2-基氧基)乙酸甲酯。 |
| Q: 2-(1,3-二氧代异吲哚啉-2-基氧基)乙酸甲酯的分子量是多少? |
| A: 2-(1,3-二氧代异吲哚啉-2-基氧基)乙酸甲酯分子量为235.19300。 |
| Q: 2-(1,3-二氧代异吲哚啉-2-基氧基)乙酸甲酯的InChIKey是什么? |
| A: 2-(1,3-二氧代异吲哚啉-2-基氧基)乙酸甲酯InChIKey为MSKBUVDLWGTLAC-UHFFFAOYSA-N。 |
| Q: 2-(1,3-二氧代异吲哚啉-2-基氧基)乙酸甲酯有哪些英文别名? |
| A: 2-(1,3-二氧代异吲哚啉-2-基氧基)乙酸甲酯英文别名有:methyl [(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)oxy]acetate、 [(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)oxy]-acetic acid,methyl ester、 methyl 2-(1,3-dioxoisoindolin-2-yloxy)acetate、 Methyl phthalimido-oxyactate、 N-methoxycarbonylmethyloxyphthalimide、 (1,3-Dioxo-1,3-dihydro-isoindol-2-yloxy)-acetic acid methyl ester、 methyl (phthalimidooxy)acetate、 HMS1608N03。 |
| Q: 2-(1,3-二氧代异吲哚啉-2-基氧基)乙酸甲酯的分子式是什么? |
| A: 2-(1,3-二氧代异吲哚啉-2-基氧基)乙酸甲酯分子式为C11H9NO5。 |
| Q: 2-(1,3-二氧代异吲哚啉-2-基氧基)乙酸甲酯的上游原料有哪些? |
| A: 2-(1,3-二氧代异吲哚啉-2-基氧基)乙酸甲酯相关上游原料(CAS):524-38-9;96-32-2;70206-52-9。 |
| Q: 2-(1,3-二氧代异吲哚啉-2-基氧基)乙酸甲酯的LogP(油水分配系数)是多少? |
| A: 2-(1,3-二氧代异吲哚啉-2-基氧基)乙酸甲酯LogP(油水分配系数)为0.32510。 |
| Q: 2-(1,3-二氧代异吲哚啉-2-基氧基)乙酸甲酯的SMILES表达式是什么? |
| A: 2-(1,3-二氧代异吲哚啉-2-基氧基)乙酸甲酯SMILES表达式为COC(=O)CON1C(=O)c2ccccc2C1=O。 |
| Q: 2-(1,3-二氧代异吲哚啉-2-基氧基)乙酸甲酯的CAS号是多少? |
| A: 2-(1,3-二氧代异吲哚啉-2-基氧基)乙酸甲酯CAS号为80733-98-8。 |