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(1,1-二氧化-3-氧代-1,2-苯异噻唑-2(3h)-基)乙酸

更新时间:2025-09-18 11:01:46

(1,1-二氧化-3-氧代-1,2-苯异噻唑-2(3h)-基)乙酸结构式
(1,1-二氧化-3-氧代-1,2-苯异噻唑-2(3h)-基)乙酸结构式
品牌特惠专场
常用名 (1,1-二氧化-3-氧代-1,2-苯异噻唑-2(3h)-基)乙酸 英文名 (1,1,2,3,3,3-HEXAFLUOROPROPYL)-1,4-DIOXANE,RACEMIC
CAS号 52188-11-1 分子量 241.22100
密度 1.665g/cm3 沸点 514ºC at 760 mmHg
分子式 C9H7NO5S 熔点 N/A
MSDS N/A 闪点 264.7ºC

 名称

中文名 (1,1-二氧化-3-氧代-1,2-苯异噻唑-2(3h)-基)乙酸
英文名 2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)acetic acid

 物理化学性质

密度 1.665g/cm3
沸点 514ºC at 760 mmHg
分子式 C9H7NO5S
分子量 241.22100
闪点 264.7ºC
精确质量 241.00400
PSA 100.13000
LogP 0.93440
InChIKey MQAZHTHFEBUHCD-UHFFFAOYSA-N
SMILES O=C(O)CN1C(=O)c2ccccc2S1(=O)=O
折射率 1.653

 安全信息

海关编码 2934999090

 合成线路

~86%

(1,1-二氧化-3-氧代-1,2-苯异噻唑-2(3h)-基)乙酸结构式

(1,1-二氧化-3-氧代-1...

52188-11-1

文献:D'Ascenzio, Melissa; Carradori, Simone; De Monte, Celeste; Secci, Daniela; Ceruso, Mariangela; Supuran, Claudiu T. Bioorganic and Medicinal Chemistry, 2014 , vol. 22, # 6 p. 1821 - 1831

~%

(1,1-二氧化-3-氧代-1,2-苯异噻唑-2(3h)-基)乙酸结构式

(1,1-二氧化-3-氧代-1...

52188-11-1

文献:Chiesi Farmaceutici S.p.A.; ARMANI, Elisabetta; Amari, Gabriele; Capaldi, Carmelida; Carzaniga, Laura; La Porta, Elena; Guala, Matilde Patent: US2013/102576 A1, 2013 ;

~%

(1,1-二氧化-3-氧代-1,2-苯异噻唑-2(3h)-基)乙酸结构式

(1,1-二氧化-3-氧代-1...

52188-11-1

文献:Wrobel, Jay; Dietrich, Arlene; Woolson, Shiela A.; Millen, Jane; McCaleb, Michael; et al. Journal of Medicinal Chemistry, 1992 , vol. 35, # 24 p. 4613 - 4627

~54%

(1,1-二氧化-3-氧代-1,2-苯异噻唑-2(3h)-基)乙酸结构式

(1,1-二氧化-3-氧代-1...

52188-11-1

文献:Soubh; Besch; Otto, Hans-Hartwig Pharmazie, 2002 , vol. 57, # 6 p. 384 - 392

~56%

(1,1-二氧化-3-氧代-1,2-苯异噻唑-2(3h)-基)乙酸结构式

(1,1-二氧化-3-氧代-1...

52188-11-1

文献:Arief Phosphorus, Sulfur and Silicon and Related Elements, 1996 , vol. 114, # 1-4 p. 129 - 134

~%

(1,1-二氧化-3-氧代-1,2-苯异噻唑-2(3h)-基)乙酸结构式

(1,1-二氧化-3-氧代-1...

52188-11-1

文献:Abe; Yamamoto Yakugaku Zasshi, 1953 , vol. 73, p. 1322,1325 Chem.Abstr., 1955 , p. 177

~%

(1,1-二氧化-3-氧代-1,2-苯异噻唑-2(3h)-基)乙酸结构式

(1,1-二氧化-3-氧代-1...

52188-11-1

文献:Reddy, Yervala D.; Kumar, Padam P.; Devi, Bhoomireddy R.; Dubey, Pramod K.; Kumari, Yalamanchili B. Letters in Organic Chemistry, 2013 , vol. 10, # 1 p. 70 - 76

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(1,1-二氧化-3-氧代-1,2-苯异噻唑-2(3h)-基)乙酸结构式

(1,1-二氧化-3-氧代-1...

52188-11-1

文献:Miao, Lei; Xu, Liang; Narducy, Kenneth W.; Trudell, Mark L. Organic Process Research and Development, 2009 , vol. 13, # 4 p. 820 - 822

 海关

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%

 靶点实验

查看更多实验

实验名称:Selectivity ratio of Ki for human carbonic anhydrase 1 to Ki for human carbonic anhyd...
来源:ChEMBL
靶标:N/A
External Id:CHEMBL3129536
实验名称:Selectivity ratio of Ki for human carbonic anhydrase 2 to Ki for human carbonic anhyd...
来源:ChEMBL
靶标:N/A
External Id:CHEMBL3129537
实验名称:Inhibition of human carbonic anhydrase 12 by stopped-flow CO2 hydrase assay
来源:ChEMBL
靶标:Carbonic anhydrase 12
External Id:CHEMBL3129538
实验名称:Inhibition of human carbonic anhydrase 9 by stopped-flow CO2 hydrase assay
来源:ChEMBL
靶标:Carbonic anhydrase 9
External Id:CHEMBL3129539
实验名称:Inhibition of human carbonic anhydrase 1 by stopped-flow CO2 hydrase assay
来源:ChEMBL
靶标:Carbonic anhydrase 1
External Id:CHEMBL3129540
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
实验名称:Inhibition of human carbonic anhydrase 2 by stopped-flow CO2 hydrase assay
来源:ChEMBL
靶标:Carbonic anhydrase 2
External Id:CHEMBL3129541
实验名称:Cell-based high throughput primary assay to identify activators of GPR151
来源:The Scripps Research Institute Molecular Screening Center
靶标:RecName: Full=G-protein coupled receptor 151; AltName: Full=G-protein coupled receptor PGR7; AltName: Full=GPCR-2037; AltName: Full=Galanin receptor 4; AltName: Full=Galanin-receptor-like protein; Short=GalRL
External Id:GPR151_PHUNTER_AG_LUMI_1536_1X%ACT
实验名称:Dicer-mediated maturation of pre-microRNA
来源:Center for Chemical Genomics, University of Michigan
靶标:N/A
External Id:TargetID_659_CEMA
实验名称:Inhibition of human recombinant carbonic anhydrase 12 preincubated for 15 mins by sto...
来源:ChEMBL
靶标:Carbonic anhydrase 12
External Id:CHEMBL3762504
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