CAS Number23851-84-5
Synonymsethyl 4-hydroxy-8-trifluoromethylquinoline-3-carboxylate; EINECS 245-914-2; MFCD00173387; Ethyl 4-hydroxy-8-(trifluoromethyl)-3-quinolinecarboxylate; 4-Hydroxy-8-trifluoromethylquinoline-3-carboxylic acid ethyl ester; 4-hydroxy-8-trifluoromethyl-quinoline-3-carboxylic acid ethyl ester; 3-Carbethoxy-4-hydroxy-8-trifluormethyl-chinolin; Ethyl 4-hydroxy-8-(trifluoromethyl)quinoline-3-carboxylate; 3-Quinolinecarboxylic acid, 4-hydroxy-8-(trifluoromethyl)-, ethyl ester
Molecular FormulaC13H10F3NO3
Molecular Weight285.219
Purity98%
Density1.4±0.1 g/cm3
Boiling Point343.5±37.0 °C at 760 mmHg
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 23851-84-5 |
| Catalog No. | 2A-9005873 |
| Chinese Name | 4-羟基-8-三氟甲基喹啉-3-甲酸乙酯 |
| Synonyms | ethyl 4-hydroxy-8-trifluoromethylquinoline-3-carboxylate; EINECS 245-914-2; MFCD00173387; Ethyl 4-hydroxy-8-(trifluoromethyl)-3-quinolinecarboxylate; 4-Hydroxy-8-trifluoromethylquinoline-3-carboxylic acid ethyl ester; 4-hydroxy-8-trifluoromethyl-quinoline-3-carboxylic acid ethyl ester; 3-Carbethoxy-4-hydroxy-8-trifluormethyl-chinolin; Ethyl 4-hydroxy-8-(trifluoromethyl)quinoline-3-carboxylate; 3-Quinolinecarboxylic acid, 4-hydroxy-8-(trifluoromethyl)-, ethyl ester |
| Molecular Formula | C13H10F3NO3 |
| Molecular Weight | 285.219 |
| Purity | 98 |
| Density | 1.4±0.1 g/cm3 |
| Boiling Point | 343.5±37.0 °C at 760 mmHg |
| Storage Condition | Room temperature, dry |
| HTC | 2933499090 |
| SMILES | CCOC(=O)c1c[nH]c2c(C(F)(F)F)cccc2c1=O |
| InChI | InChI=1S/C13H10F3NO3/c1-2-20-12(19)8-6-17-10-7(11(8)18)4-3-5-9(10)13(14,15)16/h3-6H,2H2,1H3,(H,17,18) |
| InChI Key | XSNJFNKOHAUNPO-UHFFFAOYSA-N |
| MSDS | msds/5873_1_23851_84_5.pdf |
| Use of | health and chemical hazard data given on this sheet. Store in closed vessels. 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 Melting point: Flash point:No data Molecular formula:C13H10F3NO3 Molecular weight:285.2 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. Section11. Toxicological information Section12. Ecological information 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 Toxicological Information CHEMICAL IDENTIFICATION RTECS NUMBER : CHEMICAL NAME : 3-Quinolinecarboxylic acid, 4-hydroxy-8-(trifluoromethyl)-, ethyl ester CAS REGISTRY NUMBER : 23851-84-5 LAST UPDATED : DATA ITEMS CITED : MOLECULAR FORMULA : C13-H10-F3-N-O3 MOLECULAR WEIGHT : WISWESSER LINE NOTATION : T66 BNJ DVO2 EQ JXFFF HEALTH HAZARD DATA ACUTE TOXICITY DATA TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Intravenous SPECIES OBSERVED : Rodent - mouse DOSE/DURATION : TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#04777 Safety Information Hazard Codes Xi HS Code 2933499090 Synthetic Route 2-((2-TRIFLUORO... CAS#:23779-94-4 Ethyl 4-hydroxy... CAS#:23851-84-5 Literature: Garudachari; Isloor, Arun M.; Satyanarayana; Fun, Hoong-Kun; Hegde, Gurumurthy European Journal of Medicinal Chemistry, 2014 , vol. 74, p. 324 - 332 Diethyl ethoxym... CAS#:87-13-8 Ethyl 4-hydroxy... CAS#:23851-84-5 Literature: European Journal of Medicinal Chemistry, , vol. 46, # 11 p. 5283 - 5292 2-Aminobenzotri... CAS#:88-17-5 Ethyl 4-hydroxy... CAS#:23851-84-5 Literature: European Journal of Medicinal Chemistry, , vol. 46, # 11 p. 5283 - 5292 Precursor & DownStream Precursor 3 CAS#:23779-94-4 2-((2-TRIFLUORO... CAS#:87-13-8 Diethyl ethoxym... CAS#:88-17-5 2-Aminobenzotri... DownStream 3 CAS#:31602-11-6 4-CHLORO-8-(TRI... CAS#:23779-95-5 4-Hydroxy-8-(tr... CAS#:854778-26-0 3-Bromo-4-hydro... |
| Tax Rebate | 13.0% |
| Supervision | None. MFN tariff: 6.5%. Ordinary tariff: 20.0% |
| Transport Info | Product name: Summary 2933499090. other compounds containing in the structure a quinoline or isoquinoline ring-system (whether or not hydrogenated), not further fused. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
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