2-(4-TRIFLUOROMETHYL-PHENYL)-THIAZOLE-4-CARBOXYLIC ACID ETHYL ESTER
2-(4-TRIFLUOROMETHYL-PHENYL)-THIAZOLE-4-CARBOXYLIC ACID ETHYL ESTER structure
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Common Name | 2-(4-TRIFLUOROMETHYL-PHENYL)-THIAZOLE-4-CARBOXYLIC ACID ETHYL ESTER | ||
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| CAS Number | 175204-88-3 | Molecular Weight | 301.28400 | |
| Density | N/A | Boiling Point | N/A | |
| Molecular Formula | C13H10F3NO2S | Melting Point | 103-106ºC | |
| MSDS | N/A | Flash Point | N/A | |
Summary: Ethyl 2-[4-(trifluoromethyl)phenyl]-1,3-thiazole-4-carboxylate, also known as 2-(4-TRIFLUOROMETHYL-PHENYL)-THIAZOLE-4-CARBOXYLIC ACID ETHYL ESTER, has a molecular formula of C13H10F3NO2S and a molecular weight of 301.28400. For research-use only, not for medical or clinical usage.
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | Ethyl 2-[4-(trifluoromethyl)phenyl]-1,3-thiazole-4-carboxylate |
|---|---|
| Synonym | More Synonyms |
This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.
| Melting Point | 103-106ºC |
|---|---|
| Molecular Formula | C13H10F3NO2S |
| Molecular Weight | 301.28400 |
| Exact Mass | 301.03800 |
| PSA | 67.43000 |
| LogP | 4.00560 |
| InChIKey | SCZAGGBIOXLKPW-UHFFFAOYSA-N |
| SMILES | CCOC(=O)c1csc(-c2ccc(C(F)(F)F)cc2)n1 |
This table provides MSDS information including hazard classification, first‑aid, fire‑fighting, spill handling, operation and storage instructions.
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Material Safety Data Sheet
Section1. Identification of the substance Product Name: 2-(4-Trifluoromethyl-phenyl)-thiazole-4-carboxylic acid ethyl ester Synonyms: Section2. Hazards identification Harmful by inhalation, in contact with skin, and if swallowed. Section3. Composition/information on ingredients. Ingredient name:2-(4-Trifluoromethyl-phenyl)-thiazole-4-carboxylic acid ethyl ester CAS number:175204-88-3 Section4. First aid measures Skin contact:Immediately wash skin with copious amounts of water for at least 15 minutes while removing contaminated clothing and shoes. If irritation persists, seek medical attention. Eye contact:Immediately wash skin with copious amounts of water for at least 15 minutes. Assure adequate flushing of the eyes by separating the eyelids with fingers. If irritation persists, seek medical attention. Inhalation:Remove to fresh air. In severe cases or if symptoms persist, seek medical attention. Ingestion:Wash out mouth with copious amounts of water for at least 15 minutes. Seek medical attention. Section5. Fire fighting measures In the event of a fire involving this material, alone or in combination with other materials, use dry powder or carbon dioxide extinguishers. Protective clothing and self-contained breathing apparatus should be worn. Section6. Accidental release measures Personal precautions: Wear suitable personal protective equipment which performs satisfactorily and meets local/state/national standards. Respiratory precaution:Wear approved mask/respirator Hand precaution:Wear suitable gloves/gauntlets Skin protection:Wear suitable protective clothing Eye protection:Wear suitable eye protection Methods for cleaning up: Mix with sand or similar inert absorbent material, sweep up and keep in a tightly closed container for disposal. See section 12. Environmental precautions: Do not allow material to enter drains or water courses. Section7. Handling and storage Handling:This product should be handled only by, or under the close supervision of, those properly qualified in the handling and use of potentially hazardous chemicals, who should take into account the fire, health and chemical hazard data given on this sheet. Store in closed vessels, refrigerated. Storage: Section8. Exposure Controls / Personal protection Engineering Controls: Use only in a chemical fume hood. Personal protective equipment: Wear laboratory clothing, chemical-resistant gloves and safety goggles. General hydiene measures: Wash thoroughly after handling. Wash contaminated clothing before reuse. Section9. Physical and chemical properties Appearance:Not specified Boiling point:No data No data Melting point: Flash point:No data Density:No data Molecular formula:C13H10F3NO2S Molecular weight:301.3 Section10. Stability and reactivity Conditions to avoid: Heat, flames and sparks. Materials to avoid: Oxidizing agents. Possible hazardous combustion products: Carbon monoxide, nitrogen oxides, hydrogen fluoride, sulfur oxides. Section11. Toxicological information No data. Section12. Ecological information No data. Section13. Disposal consideration Arrange disposal as special waste, by licensed disposal company, in consultation with local waste disposal authority, in accordance with national and regional regulations. Section14. Transportation information Non-harzardous for air and ground transportation. Section15. Regulatory information No chemicals in this material are subject to the reporting requirements of SARA Title III, Section 302, or have known CAS numbers that exceed the threshold reporting levels established by SARA Title III, Section 313. SECTION 16 - ADDITIONAL INFORMATION N/A |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| HS Code | 2934100090 |
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This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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~83%
2-(4-TRIFLUOROM... CAS#:175204-88-3 |
| Literature: Wang, Yiyun; Li, Ziyuan; Huang, Yue; Tang, Changhua; Wu, Xiaoming; Xu, Jinyi; Yao, Hequan Tetrahedron, 2011 , vol. 67, # 38 p. 7406 - 7411 |
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~88%
2-(4-TRIFLUOROM... CAS#:175204-88-3 |
| Literature: Huang, Yue; Gan, Haifeng; Li, Shang; Xu, Jinyi; Wu, Xiaoming; Yao, Hequan Tetrahedron Letters, 2010 , vol. 51, # 13 p. 1751 - 1753 |
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~61%
2-(4-TRIFLUOROM... CAS#:175204-88-3 |
| Literature: Kuo, Gee-Hong; Zhang, Yan; Shen, Lan; Lu, Songfeng; Demarest, Keith T.; Peiton, Patricia Patent: US2007/244094 A1, 2007 ; Location in patent: Page/Page column 42 ; |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 2 | |
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| DownStream 0 | |
This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2934100090 |
|---|---|
| Summary | 2934100090 other compounds containing an unfused thiazole ring (whether or not hydrogenated) in the structure VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:20.0% |
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| ethyl 2-[4-(trifluoromethyl)phenyl]thiazole-4-carboxylate |
| [4-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-phenoxy]-acetic acid ethyl ester |
| 2-[4-(trifluoromethyl)phenyl]thiazole-4-carboxylic acid ethyl ester |
| 4-(Ethoxycarbonyl)methoxyphenylboronic acid |
| 4-(2-Ethoxy-2-oxoethoxy)phenylboronic acid,pinacol ester |
| Ethyl 2-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy)acetate |
| Ethyl [4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-phenoxy]acetate |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the SMILES notation of Ethyl 2-[4-(trifluoromethyl)phenyl]-1,3-thiazole-4-carboxylate? |
| A: SMILES notation of Ethyl 2-[4-(trifluoromethyl)phenyl]-1,3-thiazole-4-carboxylate is CCOC(=O)c1csc(-c2ccc(C(F)(F)F)cc2)n1. |
| Q: What is the polar surface area (PSA) of Ethyl 2-[4-(trifluoromethyl)phenyl]-1,3-thiazole-4-carboxylate? |
| A: Polar surface area (PSA) of Ethyl 2-[4-(trifluoromethyl)phenyl]-1,3-thiazole-4-carboxylate is 67.43000. |
| Q: What is the melting point of Ethyl 2-[4-(trifluoromethyl)phenyl]-1,3-thiazole-4-carboxylate? |
| A: Melting point of Ethyl 2-[4-(trifluoromethyl)phenyl]-1,3-thiazole-4-carboxylate is 103-106ºC. |
| Q: What is the English name of Ethyl 2-[4-(trifluoromethyl)phenyl]-1,3-thiazole-4-carboxylate? |
| A: The English name of Ethyl 2-[4-(trifluoromethyl)phenyl]-1,3-thiazole-4-carboxylate is Ethyl 2-[4-(trifluoromethyl)phenyl]-1,3-thiazole-4-carboxylate. |
| Q: What is the molecular formula of Ethyl 2-[4-(trifluoromethyl)phenyl]-1,3-thiazole-4-carboxylate? |
| A: Molecular formula of Ethyl 2-[4-(trifluoromethyl)phenyl]-1,3-thiazole-4-carboxylate is C13H10F3NO2S. |
| Q: What is the molecular weight of Ethyl 2-[4-(trifluoromethyl)phenyl]-1,3-thiazole-4-carboxylate? |
| A: Molecular weight of Ethyl 2-[4-(trifluoromethyl)phenyl]-1,3-thiazole-4-carboxylate is 301.28400. |
| Q: What is the LogP of Ethyl 2-[4-(trifluoromethyl)phenyl]-1,3-thiazole-4-carboxylate? |
| A: LogP of Ethyl 2-[4-(trifluoromethyl)phenyl]-1,3-thiazole-4-carboxylate is 4.00560. |
| Q: What are the upstream materials of Ethyl 2-[4-(trifluoromethyl)phenyl]-1,3-thiazole-4-carboxylate? |
| A: Related upstream materials(CAS) of Ethyl 2-[4-(trifluoromethyl)phenyl]-1,3-thiazole-4-carboxylate: 70-23-5;72505-21-6. |
| Q: What is the InChIKey of Ethyl 2-[4-(trifluoromethyl)phenyl]-1,3-thiazole-4-carboxylate? |
| A: InChIKey of Ethyl 2-[4-(trifluoromethyl)phenyl]-1,3-thiazole-4-carboxylate is SCZAGGBIOXLKPW-UHFFFAOYSA-N. |
| Q: What is the CAS number of Ethyl 2-[4-(trifluoromethyl)phenyl]-1,3-thiazole-4-carboxylate? |
| A: CAS number of Ethyl 2-[4-(trifluoromethyl)phenyl]-1,3-thiazole-4-carboxylate is 175204-88-3. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Shanghai Nianxing Industrial Co., Ltd |
| Dayang Chem (Hangzhou) Co., Ltd. |