Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
3,5-Dibromo-4-cyanopyridine |
EINECS | N/A |
CAS No. | 870244-34-1 | Density | 2.19g/cm3 |
PSA | 36.68000 | LogP | 2.47828 |
Solubility | N/A | Melting Point |
149-151°C |
Formula | C6H2Br2N2 | Boiling Point | 317.6 °C at 760 mmHg |
Molecular Weight | 261.903 | Flash Point | 145.9 °C |
Transport Information | UN3439 | Appearance | N/A |
Safety | 26-36/37/39-45 | Risk Codes | 25-41-43 |
Molecular Structure | Hazard Symbols | T | |
Synonyms |
3,5-Dibromoisonicotinonitrile; |
Article Data | 3 |
The 4-Pyridinecarbonitrile,3,5-dibromo-, with CAS registry number 870244-34-1, has the systematic name of 3,5-dibromopyridine-4-carbonitrile. Besides this, it is also called 4-Cyano-3,5-dibromopyridine. And the chemical formula of this chemical is C6H2Br2N2.
Physical properties of 4-Pyridinecarbonitrile,3,5-dibromo-: (1)ACD/LogP: 2.01; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.01; (4)ACD/LogD (pH 7.4): 2.01; (5)#H bond acceptors: 2; (6)#H bond donors: 0; (7)#Freely Rotating Bonds: 0; (8)Polar Surface Area: 36.68 Å2; (9)Index of Refraction: 1.67; (10)Molar Refractivity: 44.56 cm3; (11)Molar Volume: 119.1 cm3; (12)Polarizability: 17.66×10-24cm3; (13)Surface Tension: 75 dyne/cm; (14)Density: 2.19 g/cm3; (15)Flash Point: 145.9 °C; (16)Enthalpy of Vaporization: 55.91 kJ/mol; (17)Boiling Point: 317.6 °C at 760 mmHg; (18)Vapour Pressure: 0.00038 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: N#Cc1c(Br)cncc1Br
(2)InChI: InChI=1/C6H2Br2N2/c7-5-2-10-3-6(8)4(5)1-9/h2-3H
(3)InChIKey: FHVATNRRDOWTPX-UHFFFAOYAC
(4)Std. InChI: InChI=1S/C6H2Br2N2/c7-5-2-10-3-6(8)4(5)1-9/h2-3H
(5)Std. InChIKey: FHVATNRRDOWTPX-UHFFFAOYSA-N