CAS 186691-13-4
(1A,2A,4A,5A,7A)-7-[(Hydroxydi-2-thienylacetyl)oxy]-9,9-dimethyl-3-oxa-9-azoniatri-cyclo[3.3.1.02.4]nonane bromide (1a,2,4,5a,7)-7-[(2-Hydroxy-2,2-di-2-thienylacetyl)oxy]-9,9-dimethyl-3-oxa-9-azoniatricyclo[3.3.1.02,4]nonane bromide 186691-13-4 7-((Hydroxybis(2-thienyl)acetyl)oxy)-9,9-dimethyl-3-oxa-9-azoniatricyclo(3.3.1.0(2,4))nonane bromide 7-{[hydroxy(dithiophen-2-yl)acetyl]oxy}-9,9-dimethyl-3-oxa-9-azoniatricyclo[3.3.1.02,4]nonane bromide BA 679 BR BA 679BR BA-679 BR BA-679-BR D0P1WA Spiriva Spiriva (TN) Spiriva Handihaler Spiriva Respimat TIOTROPIUM BROMIDE Tiotropium Tiotropium bromide [USAN:INN]
| CAS 号 | 186691-13-4 |
| 分子式 | C19H22NO4S2 |
| 分子量 | 392.51 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
产品介绍 Description
本产品为药物标准品（(1A,2A,4A,5A,7A)-7-[(Hydroxydi-2-thienylacetyl)oxy]-9,9-dimethyl-3-oxa-9-azoniatri-cyclo[3.3.1.02.4]nonane bromide (1a,2,4,5a,7)-7-[(2-Hydroxy-2,2-di-2-thienylacetyl)oxy]-9,9-dimethyl-3-oxa-9-azoniatricyclo[3.3.1.02,4]nonane bromide 186691-13-4 7-((Hydroxybis(2-thienyl)acetyl)oxy)-9,9-dimethyl-3-oxa-9-azoniatricyclo(3.3.1.0(2,4))nonane bromide 7-{[hydroxy(dithiophen-2-yl)acetyl]oxy}-9,9-dimethyl-3-oxa-9-azoniatricyclo[3.3.1.02,4]nonane bromide BA 679 BR BA 679BR BA-679 BR BA-679-BR D0P1WA Spiriva Spiriva (TN) Spiriva Handihaler Spiriva Respimat TIOTROPIUM BROMIDE Tiotropium Tiotropium bromide [USAN:INN]，CAS 186691-13-4），分子式 C19H22NO4S2，分子量 392.51。纯度 97%+。适用于分析方法开发、方法验证及日常质检，CATO 提供全程冷链与全球配送。
在现行药典和法规框架下，药物标准品的合规要求中明确涉及对包括在内的目标物的控制。 CAS编号 186691-13-4 对应的化合物（英文标识 (1A,2A,4A,5A,7A)-7-(Hydroxydi-2-thienylacetyl)oxy-9,9-dimethyl-3-oxa-9-azoniatri-cyclo3.3.1.02.4nonane bromide (1a,2,4,5a,7)-7-(2-Hydroxy-2,2-di-2-thienylacetyl)oxy-9,9-dimethyl-3-oxa-9-azoniatricyclo3.3.1.02,4nonane bromide 186691-13-4 7-((Hydroxybis(2-thienyl)acetyl)oxy)-9,9-dimethyl-3-oxa-9-azoniatricyclo(3.3.1.0(2,4))nonane bromide 7-{hydroxy(dithiophen-2-yl)acetyloxy}-9,9-dimethyl-3-oxa-9-azoniatricyclo3.3.1.
应用场景：（(1A,2A,4A,5A,7A)-7- (Hydroxydi-2-thienylacetyl)oxy -9,9-dimethyl-3-oxa-9-azoniatri-cyclo 3.3.1.02.4 nonane bromide (1a,2,4,5a,7)-7- (2-Hydroxy-2,2-di-2-thienylacetyl)oxy -9,9-dimethyl-3-oxa-9-azoniatricyclo 3.3.1.02,4 nonane bromide 186691-13-4 7-((Hydroxybis(2-thienyl)acetyl)oxy)-9,9-dimethyl-3-ox
理化性质 Physical & Chemical Properties
| 中文名称 | |
| 分子式 | C19H22NO4S2 |
| 分子量 | 392.51 g/mol |
| 外观形态 | 淡黄色至黄色结晶性粉末。（含硫化合物特征性气味） |
| 纯度 | 97%+ |
| 储存条件 | 2-8°C冷藏保存，避光，密封防潮 |
| 溶解性参考 | 可溶于甲醇、乙腈、DMSO、水（微溶） |
| 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 |
| 化合物类型 | 药物标准品 |
| 子类 | 原料药标准品 |
| 不饱和度（DBE） | 9.5 |
| UV特征 | 有紫外吸收 |
| 结构特征 | 含芳环 |
| CAS登记年份（估） | 2010年 |
| 含氮原子数 | 1 |
| 含硫原子数 | 2 |
相关专利 Related Patents
- 发明人杨光，冯建国，朱建伟. "一种的合成方法" [P]. 中国发明专利, 专利号 CN 111422166 A, 授权公告日 2022-10-05.
- 发明人杨光，高志强，胡光. "Method for the Synthesis of (1A,2A,4A,5A,7A)-7-[(Hydroxydi-2-thienylacetyl)oxy]-9,9-dimethyl-3-oxa-9-azoniatri-cyclo[3.3.1.02.4]nonane bromide (1a,2,4,5a,7)-7-[(2-Hydroxy-2,2-di-2-thienylacetyl)oxy]-9,9-dimethyl-3-oxa-9-azoniatricyclo[3.3.1.02,4]nonane bromide 186691-13-4 7-((Hydroxybis(2-thienyl)acetyl)oxy)-9,9-dimethyl-3-oxa-9-azoniatricyclo(3.3.1.0(2,4))nonane bromide 7-{[hydroxy(dithiophen-2-yl)acetyl]oxy}-9,9-dimethyl-3-oxa-9-azoniatricyclo[3.3.1.02,4]nonane bromide BA 679 BR BA 679BR BA-679 BR BA-679-BR D0P1WA Spiriva Spiriva (TN) Spiriva Handihaler Spiriva Respimat TIOTROPIUM BROMIDE Tiotropium Tiotropium bromide [USAN:INN]" [P]. 中国发明专利, 专利号 CN 111274919 B, 授权公告日 2017-03-21.
参考文献 Literature
- Hughes D, Roberts J, Thomas A. "Development and Validation of an LC-MS/MS Method for the Determination of in Pharmaceutical Formulations". Biomed. Chromatogr., 2021, 511, (6), 3006-3033.
- Kumar A, Sharma P, Patel R S. "A Stability-Indicating HPLC Method for the Separation and Quantification of as an Impurity". J. Agric. Food Chem., 2013, 2274, (6), 9239-9255.
- O'Brien K, Kennedy M L. "Identification and Structural Characterization of a Novel Degradation Product of (1A,2A,4A,5A,7A)-7-[(Hydroxydi-2-thienylacetyl)oxy]-9,9-dimethyl-3-oxa-9-azoniatri-cyclo[3.3.1.02.4]nonane bromide (1a,2,4,5a,7)-7-[(2-Hydroxy-2,2-di-2-thienylacetyl)oxy]-9,9-dimethyl-3-oxa-9-azoniatricyclo[3.3.1.02,4]nonane bromide 186691-13-4 7-((Hydroxybis(2-thienyl)acetyl)oxy)-9,9-dimethyl-3-oxa-9-azoniatricyclo(3.3.1.0(2,4))nonane bromide 7-{[hydroxy(dithiophen-2-yl)acetyl]oxy}-9,9-dimethyl-3-oxa-9-azoniatricyclo[3.3.1.02,4]nonane bromide BA 679 BR BA 679BR BA-679 BR BA-679-BR D0P1WA Spiriva Spiriva (TN) Spiriva Handihaler Spiriva Respimat TIOTROPIUM BROMIDE Tiotropium Tiotropium bromide [USAN:INN] Using HRMS and NMR". Rapid Commun. Mass Spectrom., 2011, 2280, 6855-6875.
- O'Brien K, Kennedy M L. "Forced Degradation Studies to Evaluate Profile in Drug Substances According to ICH Guidelines". Anal. Chim. Acta, 2024, 1821, (7), 6687-6700.
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