Introduction：Basic information about 3-Iodotoluene CAS 625-95-6, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
3-Iodotoluene Basic information
| Product Name: | 3-Iodotoluene |
| Synonyms: | 3-IodotoL;3-Methyl-iodobenzene;3-Iodotoluene,1-Iodo-3-methylbenzene;3-lodotoluene;3-iodotoiuene;1-iodo-3-methyl-benzen;M-IODOTOLUENE;3-methylphenyliodide |
| CAS: | 625-95-6 |
| MF: | C7H7I |
| MW: | 218.04 |
| EINECS: | 210-918-5 |
| Product Categories: | Iodine Compounds;Aromatic Hydrocarbons (substituted) & Derivatives |
| Mol File: | 625-95-6.mol |
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3-Iodotoluene Chemical Properties
| Melting point | -27°C |
| Boiling point | 80-82 °C10 mm Hg(lit.) |
| density | 1.698 g/mL at 25 °C(lit.) |
| refractive index | n20/D 1.604(lit.) |
| Fp | 180 °F |
| storage temp. | Keep in dark place,Sealed in dry,Room Temperature |
| form | clear liquid |
| color | Colorless to Red to Green |
| Specific Gravity | 1.700 (20/4℃) |
| Water Solubility | Not miscible in water. Soluble in benzene, alcohol and ether. |
| Sensitive | Light Sensitive |
| BRN | 1903634 |
| InChI | 1S/C7H7I/c1-6-3-2-4-7(8)5-6/h2-5H,1H3 |
| InChIKey | VLCPISYURGTGLP-UHFFFAOYSA-N |
| SMILES | Cc1cccc(I)c1 |
| CAS DataBase Reference | 625-95-6(CAS DataBase Reference) |
| NIST Chemistry Reference | Benzene, 1-iodo-3-methyl-(625-95-6) |
| EPA Substance Registry System | m-Iodotoluene (625-95-6) |
Safety Information
| Hazard Codes | Xi |
| Risk Statements | 36/37/38 |
| Safety Statements | 26-36-36/37/39-27 |
| RIDADR | UN 2810 |
| WGK Germany | 2 |
| RTECS | DA3440000 |
| TSCA | TSCA listed |
| HazardClass | IRRITANT |
| HS Code | 29039990 |
| Storage Class | 10 - Combustible liquids |
| Hazard Classifications | Eye Irrit. 2
Skin Irrit. 2
STOT SE 3 |
3-Iodotoluene Usage And Synthesis
| Chemical Properties | clear colorless to slightly yellow liquid |
| Uses | suzuki reaction |
| Uses | 3-Iodotoluene (1-Iodo-3-methylbenzene) was used in the preparartion of indene derivatives. |
| Synthesis Reference(s) | The Journal of Organic Chemistry, 45, p. 3728, 1980 DOI: 10.1021/jo01306a041 |
3-Iodotoluene Preparation Products And Raw materials
| Raw materials | 2,5-DIIODOTOLUENE-->Iodine, bis(acetato-κO)(3-methylphenyl)--->Benzene, 1-iodyl-3-methyl--->Benzenediazonium, 3-methyl-, tetrafluoroborate(1-)-->lithium p-toluenesulphonate-->M-TOLYLMAGNESIUM BROMIDE-->Allyltrimethylsilane-->3-Tolylboronic acid-->m-Toluidine-->3-Bromotoluene |
| Preparation Products | N,N'-Bis(3-methylphenyl)-N,N'-bis(phenyl)benzidine-->2-Iodotoluene-->4-iodo-2-Methylbenzoic acid-->4-(3'-Methylphenyl)amino-3-pyridinesulfonamide-->3-methylphenethyl bromide-->3-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)toluene-->1-METHYLANTHRACENE-->3-Phenyltoluene |
