![Methyl 4-[(trifluoromethyl)thio]benzoate structure, CAS 88489-60-5](/structures/20000/8250_1_88489_60_5.png)
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 88489-60-5 |
| Catalog No. | 2A-9008250 |
| Chinese Name | 4-三氟甲硫基苯甲酸甲酯 |
| Synonyms | MFCD06203725; Methyl 4-trifluomethylthiobenzoate; PC1546 |
| Molecular Formula | CF3C6H4CO2CH3 |
| Molecular Weight | 204.15 |
| Purity | 99 |
| Density | 1.36g/cm3 |
| Boiling Point | 94-95 °C/21 mmHg (lit.) |
| Melting Point | 13-14 °C (lit.) |
| Appearance | liquid |
| HTC | 2930909090 |
| PubChem ID | 24860132 |
| MDL Number | MFCD00042324 |
| SMILES | COC(=O)c1ccc(cc1)C(F)(F)F |
| InChI | 1S/C9H7F3O2/c1-14-8(13)6-2-4-7(5-3-6)9(10,11)12/h2-5H,1H3 |
| InChI Key | VAZWXPJOOFSNLB-UHFFFAOYSA-N |
| NACRES Code | NA.22 |
| UNSPSC | 12352100 |
| MSDS | msds/8250_1_88489_60_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:C9H7F3O2S Molecular weight:236.2 Section10. Stability and reactivity Conditions to avoid: Heat, flames and sparks. Materials to avoid: Oxidizing agents. Possible hazardous combustion products: Carbon monoxide, hydrogen fluoride, sulfur oxides. 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 Safety Information Hazard Codes F: Flammable; HS Code 2930909090 Synthetic Route Total: 1 Page 2-(Trifluoromet... CAS#:719-98-2 Methyl 4-borono... CAS#:99768-12-4 methyl 4-triflu... CAS#:88489-60-5 Literature: Pluta, Roman; Nikolaienko, Pavlo; Rueping, Magnus Angewandte Chemie - International Edition, 2014 , vol. 53, # 6 p. 1650 - 1653 Angew. Chem., 2014 , vol. 126, # 6 p. 1676 - 1679,4 (Trifluoromethy... CAS#:81290-20-2 Methyl 4-borono... CAS#:99768-12-4 methyl 4-triflu... CAS#:88489-60-5 Literature: Chen, Chao; Xie, Yan; Chu, Lingling; Wang, Ruo-Wen; Zhang, Xingang; Qing, Feng-Ling Angewandte Chemie - International Edition, 2012 , vol. 51, # 10 p. 2492 - 2495 Iodotrifluoromethane CAS#:2314-97-8 Methyl 4-Mercap... CAS#:6302-65-4 methyl 4-triflu... CAS#:88489-60-5 Literature: Kondratenko, N. V.; Kolomeitsev, A. A.; Popov, V. I.; Il'chenko, A. Ya.; Korzhenevskaya, N. G.; et al. J. Gen. Chem. USSR (Engl. Transl.), 1983 , vol. 53, # 11 p. 2500 - 2505,2254 - 2258 Precursor & DownStream Precursor 4 CAS#:99768-12-4 Methyl 4-borono... CAS#:81290-20-2 (Trifluoromethy... CAS#:2314-97-8 Iodotrifluoromethane CAS#:6302-65-4 Methyl 4-Mercap... DownStream 3 CAS#:330-17-6 4-(trifluoromet... CAS#:312-22-1 4-(trifluoromet... CAS#:88489-67-2 methyl 4-(trifl... |
| Tax Rebate | 13.0% |
| Supervision | None. MFN tariff: 6.5%. Ordinary tariff: 30.0% |
| Transport Info | Product name: Summary 2930909090. other organo-sulfur compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0% |
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