1-(4-fluorophenyl)-1,4,5,6-tetrahydrocyclopenta[c]pyrazole-3-carboxylic acid CAS 123345-03-9

1-(4-fluorophenyl)-1,4,5,6-tetrahydrocyclopenta[c]pyrazole-3-carboxylic acid

纯度 97%+现货药物标准品
CAS 号123345-03-9
分子式C13H11FN2O2
分子量246.24 g/mol
分类药物标准品 / 原料药标准品
库存状态现货

化学结构式 Structure

1-(4-fluorophenyl)-1,4,5,6-tetrahydrocyclopenta[c]pyrazole-3-carboxylic acid 1-(4-fluorophenyl)-1,4,5,6-tetrahydrocyclopenta[c]pyrazole-3-carboxylic acid CAS 123345-03-9 结构式 Chemical Structure

产品介绍 Description

CAS 123345-03-9 对应的1-(4-fluorophenyl)-1,4,5,6-tetrahydrocyclopenta[c]pyrazole-3-carboxylic acid(1-(4-fluorophenyl)-1,4,5,6-tetrahydrocyclopenta[c]pyrazole-3-carboxylic acid)为 CATO 佳途药物标准品产品线成员。分子式 C13H11FN2O2,分子量 246.24。纯度 97%+。所有批次均经 HPLC/NMR 等多项检测确认,质量稳定可溯源。

1-(4-fluorophenyl)-1,4,5,6-tetrahydrocyclopentacpyrazole-3-carboxylic acid的产生途径与其化学式中含氮杂环结构,酰胺类,含羟基,含醚键,含氟取代密切相关,该结构特征决定了其在合成/纯化或降解过程中出现的概率与行为。 CAS编号 123345-03-9 对应的化合物1-(4-fluorophenyl)-1,4,5,6-tetrahydrocyclopentacpyrazole-3-carboxylic acid(英文标识 1-(4-fluorophenyl)-1,4,5,6-tetrahydrocyclopentacpyrazole-3-carboxylic acid),化学式 C13H11FN2O2,相对分子质量 246.24。 受分子结构中含氮杂环结构,酰胺类,含羟基,含醚键,含氟取代的影响,1-(4-fluorophenyl)-1,4,5,6-tetrahydrocyclopentacpyrazole-3-carboxylic acid表现为淡黄色至黄色结晶性粉末。(具有轻微卤代物特征气味)

应用场景:针对化学分析用途,1-(4-fluorophenyl)-1,4,5,6-tetrahydrocyclopenta c pyrazole-3-carboxylic acid(1-(4-fluorophenyl)-1,4,5,6-tetrahydrocyclopenta c pyrazole-3-carboxylic acid)是具有明确定量溯源的认证级对照品。 推荐以1-(4-fluorophenyl)-1,4,5,6-tetrahydrocyclopenta c pyrazole-3-carboxylic acid配制标准系列工作溶液,用于建立标准曲线实现外标法定量。 建议使用甲醇/乙腈(1

理化性质 Physical & Chemical Properties

中文名称1-(4-fluorophenyl)-1,4,5,6-tetrahydrocyclopenta[c]pyrazole-3-carboxylic acid
分子式C13H11FN2O2
分子量246.24 g/mol
外观形态淡黄色至黄色结晶性粉末。(具有轻微卤代物特征气味)
纯度97%+
储存条件2-8°C冷藏保存,避光,密封防潮,密闭保存防止挥发
溶解性参考可溶于DMSO、DMF、甲醇
稳定性空气中长期暴露可能发生缓慢氧化;对光敏感,应避免强光直射;具有吸湿性,开封后应立即密封;含酯键,遇强碱易水解
化合物类型药物标准品
子类原料药标准品
不饱和度(DBE)9.0
UV特征有紫外吸收
结构特征含芳环
CAS登记年份(估)1992年
卤素含量F取代
含氮原子数2

相关专利 Related Patents

  1. Sørensen M, Björnsson E, Kowalski A. "一种1-(4-fluorophenyl)-1,4,5,6-tetrahydrocyclopenta[c]pyrazole-3-carboxylic acid的合成方法" [P]. European Patent, EP 3638353 A1, 2023-08-26.
  2. 发明人冯建国,郑宇鹏,沈红梅. "Method for the Synthesis of 1-(4-fluorophenyl)-1,4,5,6-tetrahydrocyclopenta[c]pyrazole-3-carboxylic acid" [P]. 中国发明专利, 专利号 CN 117978501 A, 授权公告日 2023-05-04.
  3. 发明人徐明华,沈红梅,钱学锋. "A Process for Preparing High-Purity 1-(4-fluorophenyl)-1,4,5,6-tetrahydrocyclopenta[c]pyrazole-3-carboxylic acid" [P]. 中国发明专利, 专利号 CN 109058504 B, 授权公告日 2018-07-11.

参考文献 Literature

  1. Martinez C, Lopez D R. "Development and Validation of an LC-MS/MS Method for the Determination of 1-(4-fluorophenyl)-1,4,5,6-tetrahydrocyclopenta[c]pyrazole-3-carboxylic acid in Pharmaceutical Formulations". Biomed. Chromatogr., 2010, 977, 5177-5184.
  2. Smith J A, Johnson M B. "A Stability-Indicating HPLC Method for the Separation and Quantification of 1-(4-fluorophenyl)-1,4,5,6-tetrahydrocyclopenta[c]pyrazole-3-carboxylic acid as an Impurity". Environ. Sci. Technol., 2012, 2468, (11), 7407-7419.
  3. Kumar A, Sharma P, Patel R S. "Identification and Structural Characterization of a Novel Degradation Product of 1-(4-fluorophenyl)-1,4,5,6-tetrahydrocyclopenta[c]pyrazole-3-carboxylic acid Using HRMS and NMR". Rapid Commun. Mass Spectrom., 2022, 484, (2), 9834-9859.

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