(1,1,3-三氧代-1,3-二氢-1lambda6-苯并[d]异噻唑-2-基)-乙腈

• 常用名: (1,1,3-三氧代-1,3-二氢-1lambda6-苯并[d]异噻唑-2-基)-乙腈
• 英文名: 2-(7,9,9-trioxo-9$l^{6}-thia-8-azabicyclo[4.3.0]nona-1,3,5-trien-8-yl)acetonitrile
• CAS号: 52188-12-2
• 分子量: 222.22100
• 密度: 1.547g/cm3
• 沸点: 462.2ºC at 760 mmHg
• 分子式: C₉H₆N₂O₃S
• 熔点: 142ºC
• 闪点: 233.3ºC

名称

• 中文名: (1,1,3-三氧代-1,3-二氢-1lambda6-苯并[d]异噻唑-2-基)-乙腈
• 英文名: 2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)acetonitrile

物理化学性质

• 密度: 1.547g/cm3
• 沸点: 462.2ºC at 760 mmHg
• 熔点: 142ºC
• 分子式: C₉H₆N₂O₃S
• 分子量: 222.22100
• 闪点: 233.3ºC
• 精确质量: 222.01000
• PSA: 86.62000
• LogP: 1.37338
• InChIKey: XOOUGZKBOROESV-UHFFFAOYSA-N
• SMILES: N#CCN1C(=O)c2ccccc2S1(=O)=O
• 外观性状: 固体
• 折射率: 1.633
• 储存条件: 室温， 密封， 干燥

安全信息

• 危害码 (欧洲): Xn:Harmful;
• 风险声明 (欧洲): R20/21/22
• 安全声明 (欧洲): S36/37
• 海关编码: 2934999090

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

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实验名称：AlphaScreen-based biochemical high throughput primary assay to identify activators of... 来源：The Scripps Research Institute Molecular Screening Center 靶标：N/A External Id：FBW7_ACT_ALPHA_1536_1X%ACT PRUN

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英文别名

• 3-oxo-1,2-benzoisothiazoline-2-acetonitrile 1,1-dioxide
• saccharin-2-acetonitrile