2-(2-hydroxy-3-phenylmethoxy-propyl)isoindole-1,3-dione结构式
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常用名 | 2-(2-hydroxy-3-phenylmethoxy-propyl)isoindole-1,3-dione | 英文名 | 2-(2-hydroxy-3-phenylmethoxy-propyl)isoindole-1,3-dione |
|---|---|---|---|---|
| CAS号 | 90503-16-5 | 分子量 | 311.33200 | |
| 密度 | 1.307g/cm3 | 沸点 | 504.6ºC at 760 mmHg | |
| 分子式 | C18H17NO4 | 熔点 | N/A | |
| MSDS | N/A | 闪点 | 259ºC |
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。
| 英文名 | 2-(2-hydroxy-3-phenylmethoxypropyl)isoindole-1,3-dione |
|---|---|
| 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。
| 密度 | 1.307g/cm3 |
|---|---|
| 沸点 | 504.6ºC at 760 mmHg |
| 分子式 | C18H17NO4 |
| 分子量 | 311.33200 |
| 闪点 | 259ºC |
| 精确质量 | 311.11600 |
| PSA | 66.84000 |
| LogP | 1.79820 |
| InChIKey | BQPGTZDMUJNXJZ-UHFFFAOYSA-N |
| SMILES | O=C1c2ccccc2C(=O)N1CC(O)COCc1ccccc1 |
| 折射率 | 1.622 |
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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~70%
2-(2-hydroxy-3-... 90503-16-5 |
| 文献:Nycomed Imaging AS Patent: US5531978 A1, 1996 ; Title/Abstract Full Text Show Details Nycomed Imaging AS Patent: US5198208 A1, 1993 ; |
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~%
2-(2-hydroxy-3-... 90503-16-5 |
| 文献:Viti; Nannicini; Ricci; Pestellini; Abelli; Furio European Journal of Medicinal Chemistry, 1994 , vol. 29, # 5 p. 401 - 406 |
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~%
2-(2-hydroxy-3-... 90503-16-5 |
| 文献:Viti; Nannicini; Ricci; Pestellini; Abelli; Furio European Journal of Medicinal Chemistry, 1994 , vol. 29, # 5 p. 401 - 406 |
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~63%
2-(2-hydroxy-3-... 90503-16-5 |
| 文献:Liu; Kuzmich; Lin Tetrahedron Letters, 1984 , vol. 25, # 6 p. 613 - 616 |
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~%
2-(2-hydroxy-3-... 90503-16-5 |
| 文献:Liu; Kuzmich; Lin Tetrahedron Letters, 1984 , vol. 25, # 6 p. 613 - 616 |
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~%
2-(2-hydroxy-3-... 90503-16-5 |
| 文献:Chu; Chen; Weng; et al. Journal of Heterocyclic Chemistry, 1987 , vol. 24, # 4 p. 989 - 995 |
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~%
2-(2-hydroxy-3-... 90503-16-5 |
| 文献:Chu; Chen; Weng; et al. Journal of Heterocyclic Chemistry, 1987 , vol. 24, # 4 p. 989 - 995 |
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。
| 上游产品 6 | |
|---|---|
| 下游产品 1 | |
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: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:Primary Screen Inhibitors of CD40 Signaling in BL2 Cells Measured in Cell-Based Syste...
来源:Broad Institute
靶标:N/A
External Id:7124-01_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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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。
| HMS2499A19 |
| 2-(3-benzyloxy-2-hydroxypropyl)-1H-isoindole-1,3(2H)-dione |
| 2-Benzyloxymethyl-2-hydroxy-1-phthalimido-ethane |
| N-(3-benzoxy-2-hydroxypropyl)phthalimide |
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: 90503-16-5的英文名称是什么? |
| A: 90503-16-5英文名称为2-(2-hydroxy-3-phenylmethoxypropyl)isoindole-1,3-dione。 |
| Q: 90503-16-5的分子量是多少? |
| A: 90503-16-5分子量为311.33200。 |
| Q: 90503-16-5的LogP(油水分配系数)是多少? |
| A: 90503-16-5LogP(油水分配系数)为1.79820。 |
| Q: 90503-16-5的SMILES表达式是什么? |
| A: 90503-16-5SMILES表达式为O=C1c2ccccc2C(=O)N1CC(O)COCc1ccccc1。 |
| Q: 90503-16-5的极性表面积PSA是多少? |
| A: 90503-16-5极性表面积PSA为66.84000。 |
| Q: 90503-16-5的下游产品有哪些? |
| A: 90503-16-5相关下游产品(CAS):90503-15-4。 |
| Q: 90503-16-5的CAS号是多少? |
| A: 90503-16-5CAS号为90503-16-5。 |
| Q: 90503-16-5的中文名称是什么? |
| A: 90503-16-5的中文名称为90503-16-5。 |
| Q: 90503-16-5的上游原料有哪些? |
| A: 90503-16-5相关上游原料(CAS):2930-05-4;100-51-6;1074-82-4;85-44-9;90503-15-4;5455-98-1。 |
| Q: 90503-16-5的沸点是多少? |
| A: 90503-16-5沸点为504.6ºC at 760 mmHg。 |