CAS Number41252-97-5
Synonyms4-Iodo-1-methyl-2-nitrobenzene; EINECS 255-279-3; 4-Iodo-2-nitrotoluene; Toluene, 4-iodo-2-nitro; MFCD00051090
Molecular FormulaC7H6INO2
Molecular Weight263.036
Purity98.00%
Density1.9±0.1 g/cm3
Boiling Point286.9±20.0 °C at 760 mmHg
Melting Point43 °C
AppearanceBrown-yellow crystal
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 41252-97-5 |
| Catalog No. | 2A-9042755 |
| Chinese Name | 4-碘-2-硝基甲苯 |
| Synonyms | 4-Iodo-1-methyl-2-nitrobenzene; EINECS 255-279-3; 4-Iodo-2-nitrotoluene; Toluene, 4-iodo-2-nitro; MFCD00051090 |
| Molecular Formula | C7H6INO2 |
| Molecular Weight | 263.036 |
| Purity | 98.00 |
| Density | 1.9±0.1 g/cm3 |
| Boiling Point | 286.9±20.0 °C at 760 mmHg |
| Melting Point | 43 °C |
| Appearance | Brown-yellow crystal |
| Storage Condition | Sealed, cool and dry storage |
| HTC | 2904909090 |
| PubChem ID | 3159884 |
| MDL Number | MFCD00024329 |
| SMILES | Cc1ccc(I)cc1[N+](=O)[O-] |
| InChI | InChI=1S/C7H6INO2/c1-5-2-3-6(8)4-7(5)9(10)11/h2-4H,1H3 |
| InChI Key | QLMRDNPXYNJQMQ-UHFFFAOYSA-N |
| MSDS | msds/42755_1_41252_97_5.pdf |
| Use of | health and chemical hazard data given on this sheet. Storage:Store in closed vessels, refrigerated. 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 Not specified Appearance: Boiling point:No data Melting point:No data Flash point:No data Molecular formula:C7H6INO2 Molecular weight:263 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 Iodide. 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 Xn:Harmful; HS Code 2904909090 Synthetic Route 2-Nitrotoluene CAS#:88-72-2 4-Iodo-2-nitrot... CAS#:41252-97-5 Literature: Chaikovski; Filimonov; Yagovkin; Kharlova Tetrahedron Letters, 2000 , vol. 41, # 47 p. 9101 - 9104 2-Nitrotoluene CAS#:88-72-2 4-Iodo-2-nitrot... CAS#:41252-97-5 1-Iodo-2-methyl... CAS#:41252-98-6 Literature: Chaikovskii; Filimonov; Funk Russian Journal of Organic Chemistry, 2009 , vol. 45, # 9 p. 1349 - 1352 2-Nitrotoluene CAS#:88-72-2 4-Iodo-2-nitrot... CAS#:41252-97-5 2,4-Diiodo-6-ni... CAS#:10388-22-4 1-Iodo-2-methyl... CAS#:41252-98-6 Literature: Chaikovskii; Filimonov; Funk Russian Journal of Organic Chemistry, 2009 , vol. 45, # 9 p. 1349 - 1352 Precursor & DownStream Precursor 3 CAS#:88-72-2 2-Nitrotoluene CAS#:624-31-7 4-Iodotoluene CAS#:7697-37-2 nitric acid DownStream 6 CAS#:939-79-7 3-Nitro-4-methy... CAS#:83863-33-6 5-Iodo-2-methyl... CAS#:116529-62-5 4-Iodo-2-nitrob... CAS#:28442-37-7 1-methyl-4-(4-m... |
| Tax Rebate | 9.0% |
| Supervision | None MFN tariff: 5.5% Ordinary tariff: 30.0% |
| Transport Info | Product name: Summary HS:2904909090 sulphonated, nitrated or nitrosated derivatives of hydrocarbons, whether or not halogenated VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:5.5% General tariff:30.0% |
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