Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
3,4,5,6-Tetrachloropyridine-2-carbonitrile |
EINECS | 241-784-6 |
CAS No. | 17824-83-8 | Density | 1.75g/cm3 |
PSA | 36.68000 | LogP | 3.56688 |
Solubility | N/A | Melting Point |
148-150 °C |
Formula | C6Cl4N2 | Boiling Point | 297.4 °C at 760 mmHg |
Molecular Weight | 241.891 | Flash Point | 133.6 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
Picolinonitrile,tetrachloro- (8CI);2-Cyano-3,4,5,6-tetrachloropyridine;3,4,5,6-Tetrachloropicolinonitrile;3,4,5,6-Tetrachloropyridine-2-carbonitrile;Tetrachloro-2-cyanopyridine;Tetrachloro-2-pyridinecarbonitrile;Tetrachloropicolinonitrile; |
Article Data | 10 |
The 3,4,5,6-Tetrachloropyridine-2-carbonitrile, with CAS registry number 17824-83-8, has the systematic name of 3,4,5,6-tetrachloropyridine-2-carbonitrile. And its IUPAC name is the same one. Besides this, its superlist name is Picolinonitrile, tetrachloro-. What's more, its EINECS is 241-784-6.
Physical properties of 3,4,5,6-Tetrachloropyridine-2-carbonitrile: (1)ACD/LogP: 3.01; (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): 113.11; (6)ACD/BCF (pH 7.4): 113.11; (7)ACD/KOC (pH 5.5): 1026.84; (8)ACD/KOC (pH 7.4): 1026.84; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 36.68 Å2; (13)Index of Refraction: 1.62; (14)Molar Refractivity: 48.42 cm3; (15)Molar Volume: 137.7 cm3; (16)Polarizability: 19.19×10-24cm3; (17)Surface Tension: 69.1 dyne/cm; (18)Enthalpy of Vaporization: 53.72 kJ/mol; (19)Vapour Pressure: 0.00136 mmHg at 25°C.
Uses of 3,4,5,6-Tetrachloropyridine-2-carbonitrile: it can be used to produce 4-amino-3,5,6-trichloro-pyridine-2-carbonitrile and 6-amino-3,4,5-trichloro-2-cyanopyridine. This reaction will need reagent NH3 and solvent dimethylsulfoxide. The temperauture of this chemical is 50 ℃. The yield is about 81.3%.
You can still convert the following datas into molecular structure:
(1)SMILES: Clc1c(Cl)c(C#N)nc(Cl)c1Cl
(2)InChI: InChI=1/C6Cl4N2/c7-3-2(1-11)12-6(10)5(9)4(3)8
(3)InChIKey: KFPBGJYBKSQIAI-UHFFFAOYAS
(4)Std. InChI: InChI=1S/C6Cl4N2/c7-3-2(1-11)12-6(10)5(9)4(3)8
(5)Std. InChIKey: KFPBGJYBKSQIAI-UHFFFAOYSA-N