2,5-Dibromonicotinaldehyde (852181-11-4)

The CAS register number of 2,5-Dibromonicotinaldehyde is 852181-11-4. It also can be called as 3-Pyridinecarboxaldehyde, 2,5-dibromo- and the systematic name about this chemical is 2,5-dibromopyridine-3-carbaldehyde. The molecular formula about this chemical is C₆H₃Br₂NO and the molecular weight is 264.90.

Physical properties about 2,5-Dibromonicotinaldehyde are: (1)ACD/LogP: 2.14; (2)ACD/LogD (pH 5.5): 2.14; (3)ACD/LogD (pH 7.4): 2.14; (4)ACD/BCF (pH 5.5): 25.1; (5)ACD/BCF (pH 7.4): 25.1; (6)ACD/KOC (pH 5.5): 349.56; (7)ACD/KOC (pH 7.4): 349.56; (8)#H bond acceptors: 2; (9)#Freely Rotating Bonds: 1; (10)Polar Surface Area: 29.96Ų; (11)Index of Refraction: 1.654; (12)Molar Refractivity: 46.47 cm³; (13)Molar Volume: 126.6 cm³; (14)Polarizability: 18.42x10^-24cm³; (15)Surface Tension: 56.5 dyne/cm; (16)Enthalpy of Vaporization: 54.26 kJ/mol; (17)Boiling Point: 302.4 °C at 760 mmHg; (18)Vapour Pressure: 0.000994 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=Cc1cc(Br)cnc1Br
(2)InChI: InChI=1/C6H3Br2NO/c7-5-1-4(3-10)6(8)9-2-5/h1-3H
(3)InChIKey: HBMNFJYZMBEHNY-UHFFFAOYAQ
(4)Std. InChI: InChI=1S/C6H3Br2NO/c7-5-1-4(3-10)6(8)9-2-5/h1-3H
(5)Std. InChIKey: HBMNFJYZMBEHNY-UHFFFAOYSA-N