2,4,6-Trimethyliodobenzene supplier

Name
2,4,6-Trimethyliodobenzene
EINECS 223-709-9
CAS No. 4028-63-1
Article Data119
CAS DataBase
Density 1.534 g/cm³
Solubility
Melting Point 28-32 °C
Formula C₉H₁₁I
Boiling Point 244.9 °C at 760 mmHg
Molecular Weight 246.091
Flash Point 107.1 °C
Transport Information
Appearance yellow crystalline low melting solid
Safety 24/25
Risk Codes 36/37/38
Molecular Structure
Hazard Symbols
Synonyms Mesitylene,2-iodo- (6CI,7CI,8CI);1,3,5-Trimethyl-2-iodobenzene;1-Iodo-2,4,6-trimethylbenzene;2,4,6-Trimethyliodobenzene;2,4,6-Trimethylphenyliodide;2-Iodo-1,3,5-trimethylbenzene;2-Iodomesitylene;Iodo-2,4,6-trimethylbenzene;Iodomesitylene;Mesityl iodide;NSC 68044;
PSA 0.00000
LogP 3.21640

2,4,6-Trimethyliodobenzene Specification

The cas register number of 2,4,6-Trimethyliodobenzene is 4028-63-1. It also can be called as 1-Iodo-2,4,6-trimethylbenzene; 2-Iodomesitylene and the IUPAC Name about this chemical is 2-iodo-1,3,5-trimethylbenzene. It belongs to the Aromatic Halides (substituted). When you are using it, please avoid contact with skin and eyes.

Physical properties about 2,4,6-Trimethyliodobenzene are: (1)ACD/LogP: 4.63; (2)ACD/LogD (pH 5.5): 4.63; (3)ACD/LogD (pH 7.4): 4.63; (4)ACD/BCF (pH 5.5): 1945.25; (5)ACD/BCF (pH 7.4): 1945.25; (6)ACD/KOC (pH 5.5): 7867.65; (7)ACD/KOC (pH 7.4): 7867.65; (8)Index of Refraction: 1.583; (9)Molar Refractivity: 53.63 cm³; (10)Molar Volume: 160.3 cm³; (11)Polarizability: 21.26x10^-24cm³; (12)Surface Tension: 37.1 dyne/cm; (13)Enthalpy of Vaporization: 46.25 kJ/mol; (14)Boiling Point: 244.9 °C at 760 mmHg; (15)Vapour Pressure: 0.0462 mmHg at 25°C.

Preparation: this chemical can be prepared by 1,3,5-trimethyl-benzene. This reaction will need reagent 1-ClCH₂-4-fluoro-1,4-diazoniabicyclo[2.2.2]octane*2BF₄, I₂and solvent acetonitrile. The reaction time is 1 hour(s) with reaction temperature of 55 - 65 ℃. The yield is about 88%.

Uses of p-Chloropropiophenone: it can be used to produce dimesityl-telluride at temperature of 60 ℃. This reaction will need reagent sodium telluride and solvent dimethylformamide with reaction time of 10 hours. The yield is about 77%.

You can still convert the following datas into molecular structure:
(1)SMILES: Ic1c(cc(cc1C)C)C
(2)InChI: InChI=1/C9H11I/c1-6-4-7(2)9(10)8(3)5-6/h4-5H,1-3H3
(3)InChIKey: GTPNXFKONRIHRW-UHFFFAOYAQ
(4)Std. InChI: InChI=1S/C9H11I/c1-6-4-7(2)9(10)8(3)5-6/h4-5H,1-3H3
(5)Std. InChIKey: GTPNXFKONRIHRW-UHFFFAOYSA-N

Product Name

2,4,6-Trimethyliodobenzene

2,4,6-Trimethyliodobenzene Specification

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