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Name |
2-Chloro-5-iodo-3-methylpyridine |
EINECS | N/A |
CAS No. | 59782-89-7 | Density | 1.906 g/cm3 |
PSA | 12.89000 | LogP | 2.64800 |
Solubility | N/A | Melting Point |
N/A |
Formula | C6H5ClIN | Boiling Point | 274.191 °C at 760 mmHg |
Molecular Weight | 253.47 | Flash Point | 119.627 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
2-Chloro-5-iodo-3-methylpyridine; |
The Pyridine,2-chloro-5-iodo-3-methyl-, with CAS registry number 59782-89-7, belongs to the following product categories: (1)Pyridine; (2)Heterocyclic Compounds; (3)Pyridines. It has the systematic name of 2-chloro-5-iodo-3-methylpyridine. And the chemical formula of this chemical is C6H5ClIN.
Physical properties of Pyridine,2-chloro-5-iodo-3-methyl-: (1)ACD/LogP: 3.12; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3; (4)ACD/LogD (pH 7.4): 3; (5)ACD/BCF (pH 5.5): 88; (6)ACD/BCF (pH 7.4): 88; (7)ACD/KOC (pH 5.5): 855; (8)ACD/KOC (pH 7.4): 855; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 12.89 Å2; (13)Index of Refraction: 1.624; (14)Molar Refractivity: 46.971 cm3; (15)Molar Volume: 132.956 cm3; (16)Polarizability: 18.621×10-24cm3; (17)Surface Tension: 48.322 dyne/cm; (18)Density: 1.906 g/cm3; (19)Flash Point: 119.627 °C; (20)Enthalpy of Vaporization: 49.195 kJ/mol; (21)Boiling Point: 274.191 °C at 760 mmHg; (22)Vapour Pressure: 0.009 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Ic1cnc(Cl)c(C)c1
(2)InChI: InChI=1/C6H5ClIN/c1-4-2-5(8)3-9-6(4)7/h2-3H,1H3
(3)InChIKey: RKRUYZVVYJIPRA-UHFFFAOYAT
(4)Std. InChI: InChI=1S/C6H5ClIN/c1-4-2-5(8)3-9-6(4)7/h2-3H,1H3
(5)Std. InChIKey: RKRUYZVVYJIPRA-UHFFFAOYSA-N