1-tert-butyl-5-(trifluoromethyl)pyrazole-4-carboxylic acid
更新时间：2025-08-23 15:40:55
1-tert-butyl-5-(trifluoromethyl)pyrazole-4-carboxylic acid结构式
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常用名 | 1-tert-butyl-5-(trifluoromethyl)pyrazole-4-carboxylic acid | 英文名 | 1-tert-butyl-5-(trifluoromethyl)pyrazole-4-carboxylic acid |
|---|---|---|---|---|
| CAS号 | 142818-02-8 | 分子量 | 236.19100 | |
| 密度 | 1.34g/cm3 | 沸点 | 305ºC at 760 mmHg | |
| 分子式 | C9H11F3N2O2 | 熔点 | 115-117ºC | |
| MSDS | N/A | 闪点 | 138.3ºC |
| 英文名 | 1-tert-butyl-5-(trifluoromethyl)pyrazole-4-carboxylic acid |
|---|---|
| 英文别名 | 更多 |
| 密度 | 1.34g/cm3 |
|---|---|
| 沸点 | 305ºC at 760 mmHg |
| 熔点 | 115-117ºC |
| 分子式 | C9H11F3N2O2 |
| 分子量 | 236.19100 |
| 闪点 | 138.3ºC |
| 精确质量 | 236.07700 |
| PSA | 55.12000 |
| LogP | 2.35510 |
| InChIKey | LBPZUNLSYYEDFB-UHFFFAOYSA-N |
| SMILES | CC(C)(C)n1ncc(C(=O)O)c1C(F)(F)F |
| 蒸汽压 | 0.000369mmHg at 25°C |
| 折射率 | 1.483 |
| 危害码 (欧洲) | Xi |
|---|---|
| 海关编码 | 2933199090 |
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~81%
1-tert-butyl-5-... 142818-02-8 |
| 文献：Anderson, Kevin William; Fotouhi, Nader; Gillespie, Paul; Goodnow, Robert Alan; Guertin, Kevin Richard; Haynes, Nancy-Ellen; Myers, Michael Paul; Pietranico-Cole, Sherrie Lynn; Qi, Lida; Rossman, Pamela Loreen; Scott, Nathan Robert; Thakkar, Kshitij Chhabilbhai; Tilley, Jefferson Wright; Zhang, Qiang Patent: US2007/225280 A1, 2007 ; Location in patent: Page/Page column 18; 34 ; US 20070225280 A1 |
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~85%
1-tert-butyl-5-... 142818-02-8 |
| 文献：Okada, Etsuji; Masuda, Ryoichi; Hojo, Masaru Heterocycles, 1992 , vol. 34, # 4 p. 791 - 798 |
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~%
1-tert-butyl-5-... 142818-02-8 |
| 文献：Heterocycles, , vol. 34, # 4 p. 791 - 798 |
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~%
1-tert-butyl-5-... 142818-02-8 |
| 文献：Heterocycles, , vol. 34, # 4 p. 791 - 798 |
![3-[(Dimethylamino)methylene]-1,1,1,5,5,5-hexafluoro-2,4-pentanedi one结构式](https://image.chemsrc.com/caspic/415/142503-29-5.png)
| 海关编码 | 2933199090 |
|---|---|
| 中文概述 | 2933199090. 其他结构上有非稠合吡唑环化合物. 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, 乌洛托品请注明外观, 6－己内酰胺请注明外观, 签约日期 |
| Summary | 2933199090. other compounds containing an unfused pyrazole ring (whether or not hydrogenated) in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
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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
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实验名称：Chemical Probes of Kaposi's Sarcoma Herpes Virus Latent Infection
来源：ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
靶标：ORF 73 [Human herpesvirus 8 type M]
External Id：HMS791
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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
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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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实验名称：AlphaScreen-based biochemical high throughput primary assay to identify inhibitors of...
来源：The Scripps Research Institute Molecular Screening Center
External Id：MITF_INH_Alpha_1536_1X%INH PRUN
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| 1-tert-butyl-5-trifluoromethyl-1H-pyrazole-4-carboxylic acid |
| 1-(t-butyl)-5-trifluoromethylpyrazole-4-carboxylic acid |
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