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CAS No.: | 126325-54-0 |
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Name: | 4-AMINO-3,5-DIBROMO-2-METHYLPYRIDINE |
Molecular Structure: | |
Formula: | C6H6Br2N2 |
Molecular Weight: | 265.93 |
Synonyms: | 4-Amino-3,5-dibromo-2-methylpyridine;3,5-dibromo-2-methyl-pyridin-4-amine;4-pyridinamine, 3,5-dibromo-2-methyl-; |
Density: | 1.99 g/cm3 |
Boiling Point: | 296.2 °C at 760 mmHg |
Flash Point: | 132.9 °C |
PSA: | 38.91000 |
LogP: | 3.07840 |
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The 4-Pyridinamine,3,5-dibromo-2-methyl-, with the CAS registry number 126325-54-0, has the systematic name of 3,5-dibromo-2-methyl-pyridin-4-amine. It belongs to the product categories of Pyridine and Boronic Acid. And the molecular formula of the chemical is C6H6Br2N2.
The characteristics of 4-Pyridinamine,3,5-dibromo-2-methyl- are as followings: (1)ACD/LogP: 3.70; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.38; (4)ACD/LogD (pH 7.4): 3.69 ; (5)#H bond acceptors: 2; (6)#H bond donors: 2; (7)#Freely Rotating Bonds: 1; (8)Polar Surface Area: 38.91 Å2; (9)Index of Refraction: 1.651; (10)Molar Refractivity: 48.78 cm3; (11)Molar Volume: 133.5 cm3; (12)Polarizability: 19.34×10-24cm3; (13)Surface Tension: 56.2 dyne/cm; (14)Density: 1.99 g/cm3; (15)Flash Point: 132.9 °C; (16)Enthalpy of Vaporization: 53.59 kJ/mol; (17)Boiling Point: 296.2 °C at 760 mmHg; (18)Vapour Pressure: 0.00146 mmHg at 25°C.
Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: Cc1c(c(c(cn1)Br)N)Br
(2)InChI: InChI=1/C6H6Br2N2/c1-3-5(8)6(9)4(7)2-10-3/h2H,1H3,(H2,9,10)
(3)InChIKey: OGFASSJAUYBSPR-UHFFFAOYAO