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CAS No.: | 186593-43-1 |
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Name: | 5-AMINO-3-BROMO-2-METHYLPYRIDINE |
Article Data: | 8 |
Molecular Structure: | |
Formula: | C6H7BrN2 |
Molecular Weight: | 187.039 |
Synonyms: | 5-Bromo-6-methylpyridin-3-amine;3-Amino-5-bromo-6-methylpyridine;5-Amino-3-bromo-2-methylpyridine; |
Density: | 1.593 g/cm3 |
Melting Point: | 103.0 to 108.0 °C |
Boiling Point: | 281.3 °C at 760 mmHg |
Flash Point: | 123.9 °C |
PSA: | 38.91000 |
LogP: | 2.31590 |
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The 3-Pyridinamine,5-bromo-6-methyl-, with the CAS registry number 186593-43-1, is also known as ZINC20357574. It belongs to the product categories of Amines; Pyridines. This chemical's molecular formula is C6H7BrN2 and molecular weight is 187.03718. Its IUPAC name is called 5-bromo-6-methylpyridin-3-amine.
Physical properties of 3-Pyridinamine,5-bromo-6-methyl-: (1)ACD/LogP: 1.86; (2)ACD/LogD (pH 5.5): 1.81; (3)ACD/LogD (pH 7.4): 1.86; (4)ACD/BCF (pH 5.5): 13.75; (5)ACD/BCF (pH 7.4): 15.2; (6)ACD/KOC (pH 5.5): 220.71; (7)ACD/KOC (pH 7.4): 243.99; (8)#H bond acceptors: 2; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 1; (11)Index of Refraction: 1.617; (12)Molar Refractivity: 41.09 cm3; (13)Molar Volume: 117.3 cm3; (14)Surface Tension: 52 dyne/cm; (15)Density: 1.593 g/cm3; (16)Flash Point: 123.9 °C; (17)Enthalpy of Vaporization: 52.01 kJ/mol; (18)Boiling Point: 281.3 °C at 760 mmHg; (19)Vapour Pressure: 0.00359 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC1=C(C=C(C=N1)N)Br
(2)InChI: InChI=1S/C6H7BrN2/c1-4-6(7)2-5(8)3-9-4/h2-3H,8H2,1H3
(3)InChIKey: UCLLYIVDXZGQSZ-UHFFFAOYSA-N