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Name |
Benzenamine,2,4-diiodo-6-methyl- |
EINECS | N/A |
CAS No. | 117832-09-4 | Density | 2.359 g/cm3 |
PSA | 26.02000 | LogP | 3.36760 |
Solubility | N/A | Melting Point |
N/A |
Formula | C7H7I2N | Boiling Point | 346.2 °C at 760 mmHg |
Molecular Weight | 358.948 | Flash Point | 163.1 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
2,4-Diiodo-6-methylaniline;2,4-Diiodo-6-methylbenzenamine; |
Article Data | 4 |
The Benzenamine,2,4-diiodo-6-methyl-, with the CAS registry number 117832-09-4, is also known as 2,4-Diiodo-6-methylbenzenamine. This chemical's molecular formula is C7H7I2N and molecular weight is 358.95. What's more, its systematic name is 2,4-diiodo-6-methylaniline.
Physical properties of Benzenamine,2,4-diiodo-6-methyl- are: (1)ACD/LogP: 3.70; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.7; (4)ACD/LogD (pH 7.4): 3.7; (5)ACD/BCF (pH 5.5): 382.8; (6)ACD/BCF (pH 7.4): 382.85; (7)ACD/KOC (pH 5.5): 2457.44; (8)ACD/KOC (pH 7.4): 2457.74; (9)#H bond acceptors: 1; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 1; (12)Index of Refraction: 1.736; (13)Molar Refractivity: 61.12 cm3; (14)Molar Volume: 152.1 cm3; (15)Polarizability: 24.23×10-24cm3; (16)Surface Tension: 59.1 dyne/cm; (17)Density: 2.359 g/cm3; (18)Flash Point: 163.1 °C; (19)Enthalpy of Vaporization: 59.03 kJ/mol; (20)Boiling Point: 346.2 °C at 760 mmHg; (21)Vapour Pressure: 5.87E-05 mmHg at 25°C.
Preparation of Benzenamine,2,4-diiodo-6-methyl-: this chemical can be prepared by 2-methyl-aniline at the ambient temperature. This reaction will need reagents benzyltrimethylammonium dichloroiodate(1-), calcium carbonate and solvents CH2Cl2, methanol with the reaction time of 4 hours. The yield is about 89%.
You can still convert the following datas into molecular structure:
(1)SMILES: Ic1cc(c(N)c(I)c1)C
(2)InChI: InChI=1S/C7H7I2N/c1-4-2-5(8)3-6(9)7(4)10/h2-3H,10H2,1H3
(3)InChIKey: XVXCBRYCMVVHRA-UHFFFAOYSA-N