2-(2,4-二氧代噻唑烷-5-基)乙酸结构式
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常用名 | 2-(2,4-二氧代噻唑烷-5-基)乙酸 | 英文名 | 2-(2,4-Dioxothiazolidin-5-yl)acetic acid |
|---|---|---|---|---|
| CAS号 | 875-97-8 | 分子量 | 175.16200 | |
| 密度 | 1.6g/cm3 | 沸点 | 489.3ºC at 760 mmHg | |
| 分子式 | C5H5NO4S | 熔点 | N/A | |
| MSDS | N/A | 闪点 | 249.7ºC |
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-[(5s)-2,4-二氧代噻唑烷-5-基]乙酸酯 |
|---|---|
| 英文名 | 2-(2,4-dioxo-1,3-thiazolidin-5-yl)acetic acid |
| 中文别名 | (试剂)(2,4-DIOXO-1,3-THIAZOLIDIN-5-YL)ACETIC ACID |
| 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 | 1.6g/cm3 |
|---|---|
| 沸点 | 489.3ºC at 760 mmHg |
| 分子式 | C5H5NO4S |
| 分子量 | 175.16200 |
| 闪点 | 249.7ºC |
| 精确质量 | 174.99400 |
| PSA | 108.77000 |
| LogP | 0.14150 |
| InChIKey | NYOCHSASHNVXRM-UHFFFAOYSA-N |
| SMILES | O=C(O)CC1SC(=O)NC1=O |
| 折射率 | 1.581 |
| 储存条件 | 2-8°C, 惰性气体 |
本表记录该化合物安全警示、防护措施、禁配物、处置方式等安全相关参考信息。
| 海关编码 | 2934999090 |
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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-(2,4-二氧代噻唑烷-5-基)乙酸 875-97-8 |
| 文献:Koppireddi, Satish; Komsani, Jayaram Reddy; Avula, Sreenivas; Pombala, Sujitha; Vasamsetti, Satishbabu; Kotamraju, Srigiridhar; Yadla, Rambabu European Journal of Medicinal Chemistry, 2013 , vol. 66, p. 305 - 313 |
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~82%
2-(2,4-二氧代噻唑烷-5-基)乙酸 875-97-8 |
| 文献:Jawale, Dhanaji V.; Pratap, Umesh R.; Rahuja, Neha; Srivastava, Arvind K.; Mane, Ramrao A. Bioorganic and Medicinal Chemistry Letters, 2012 , vol. 22, # 1 p. 436 - 439 |
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~%
2-(2,4-二氧代噻唑烷-5-基)乙酸 875-97-8 |
| 文献:Deghenghi,R.; Daneault,G. Canadian Journal of Chemistry, 1960 , vol. 38, p. 1255 - 1260 |
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~%
2-(2,4-二氧代噻唑烷-5-基)乙酸 875-97-8 |
| 文献:Kretov,A.E. et al. J. Gen. Chem. USSR (Engl. Transl.), 1964 , vol. 34, p. 3063 - 3066,3099 - 3101 |
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-(2,4-二氧代噻唑烷-5-基)乙酸上游产品 5 | |
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| 2-(2,4-二氧代噻唑烷-5-基)乙酸下游产品 2 | |
本表展示该化学品海关编码、关税、监管条件等进出口海关参考数据。
| 海关编码 | 2934999090 |
|---|---|
| 中文概述 | 2934999090. 其他杂环化合物. 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 | 2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
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: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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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。
| 2,4-dioxo-5-thiazolidineacetic acid |
| 2,4-dioxothiazolidine-5-acetic acid |
| 2,4-dioxo-1,3-thiazolidine-5-acetic acid |
| (2,4-dioxothiazolidin-5-yl)acetic acid |
| 2-(2,4-dioxothiazolidin-5-yl)acetic acid |
| (2,4-dioxo-1,3-thiazolidin-5-yl)acetic acid |
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: 875-97-8的中文名称是什么? |
| A: 875-97-8的中文名称为2-[(5s)-2,4-二氧代噻唑烷-5-基]乙酸酯。 |
| Q: 2-[(5s)-2,4-二氧代噻唑烷-5-基]乙酸酯的极性表面积PSA是多少? |
| A: 2-[(5s)-2,4-二氧代噻唑烷-5-基]乙酸酯极性表面积PSA为108.77000。 |
| Q: 2-[(5s)-2,4-二氧代噻唑烷-5-基]乙酸酯的分子量是多少? |
| A: 2-[(5s)-2,4-二氧代噻唑烷-5-基]乙酸酯分子量为175.16200。 |
| Q: 2-[(5s)-2,4-二氧代噻唑烷-5-基]乙酸酯的LogP(油水分配系数)是多少? |
| A: 2-[(5s)-2,4-二氧代噻唑烷-5-基]乙酸酯LogP(油水分配系数)为0.14150。 |
| Q: 2-[(5s)-2,4-二氧代噻唑烷-5-基]乙酸酯的InChIKey是什么? |
| A: 2-[(5s)-2,4-二氧代噻唑烷-5-基]乙酸酯InChIKey为NYOCHSASHNVXRM-UHFFFAOYSA-N。 |
| Q: 2-[(5s)-2,4-二氧代噻唑烷-5-基]乙酸酯有哪些中文别名? |
| A: 2-[(5s)-2,4-二氧代噻唑烷-5-基]乙酸酯中文别名有:(试剂)(2,4-DIOXO-1,3-THIAZOLIDIN-5-YL)ACETIC ACID。 |
| Q: 2-[(5s)-2,4-二氧代噻唑烷-5-基]乙酸酯的CAS号是多少? |
| A: 2-[(5s)-2,4-二氧代噻唑烷-5-基]乙酸酯CAS号为875-97-8。 |
| Q: 2-[(5s)-2,4-二氧代噻唑烷-5-基]乙酸酯的上游原料有哪些? |
| A: 2-[(5s)-2,4-二氧代噻唑烷-5-基]乙酸酯相关上游原料(CAS):108-31-6;33176-41-9;5374-29-8;590-28-3;70-49-5。 |
| Q: 2-[(5s)-2,4-二氧代噻唑烷-5-基]乙酸酯的下游产品有哪些? |
| A: 2-[(5s)-2,4-二氧代噻唑烷-5-基]乙酸酯相关下游产品(CAS):5374-29-8;51226-17-6。 |
| Q: 2-[(5s)-2,4-二氧代噻唑烷-5-基]乙酸酯的储存条件是什么? |
| A: 2-[(5s)-2,4-二氧代噻唑烷-5-基]乙酸酯储存条件:2-8°C, 惰性气体。 |
本表列出该化合物相关生产厂商、供应商信息,包含厂家名称、产品供应相关参考信息。
| 上海阿拉丁生化科技股份有限公司 |
| 上海化源世纪贸易有限公司 |