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102249-45-6

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Basic Information
CAS No.: 102249-45-6
Name: 2,4-DIBROMO-3-AMINOPYRIDINE
Molecular Structure:
Molecular Structure of 102249-45-6 (2,4-DIBROMO-3-AMINOPYRIDINE)
Formula: C5H4Br2N2
Molecular Weight: 251.90666
Synonyms: 2,4-Dibromo-3-aminopyridine;2,4-Dibromo-3-pyridinamine;
Density: 2.147 g/cm3
Boiling Point: 324.5 °C at 760 mmHg
Flash Point: 150.1 °C
PSA: 38.91000
LogP: 2.77000
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Specification

The 3-Amino-2,4-dibromopyridine with cas registry number of 102249-45-6, belongs to the following product categorie: Pyridine. Its systematic name is 2,4-dibromopyridin-3-amine. And it is also named 3-pyridinamine, 2,4-dibromo-.

Physical properties about this chemical are: (1)ACD/LogP: 2.53; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.53; (4)ACD/LogD (pH 7.4): 2.53; (5)ACD/BCF (pH 5.5): 48.9; (6)ACD/BCF (pH 7.4): 48.9; (7)ACD/KOC (pH 5.5): 563.37; (8)ACD/KOC (pH 7.4): 563.37; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 38.91 Å2; (13)Index of Refraction: 1.672; (14)Molar Refractivity: 43.96 cm3; (15)Molar Volume: 117.3 cm3; (16)Polarizability: 17.42×10-24cm3; (17)Surface Tension: 61.3 dyne/cm; (18)Enthalpy of Vaporization: 56.65 kJ/mol; (19)Vapour Pressure: 0.000244 mmHg at 25°C.

You can still convert the following datas into molecular structure: 
(1)SMILES:Brc1ccnc(Br)c1N;
(2)InChI:InChI=1/C5H4Br2N2/c6-3-1-2-9-5(7)4(3)8/h1-2H,8H2;
(3)InChIKey:FCDIANNJBNOJDX-UHFFFAOYAR;
(4)Std. InChI:InChI=1S/C5H4Br2N2/c6-3-1-2-9-5(7)4(3)8/h1-2H,8H2;
(5)Std. InChIKey:FCDIANNJBNOJDX-UHFFFAOYSA-N