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CAS No.: | 38185-55-6 |
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Name: | 2-AMINO-3-CHLORO-5-BROMOPYRIDINE |
Article Data: | 18 |
Molecular Structure: | |
Formula: | C5H4BrClN2 |
Molecular Weight: | 207.457 |
Synonyms: | 2-Amino-3-chloro-5-bromopyridine;2-Amino-5-bromo-3-chloropyridine; |
Density: | 1.835 g/cm3 |
Boiling Point: | 232.551 °C at 760 mmHg |
Flash Point: | 94.444 °C |
PSA: | 38.91000 |
LogP: | 2.66090 |
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The 2-Pyridinamine,5-bromo-3-chloro-, with CAS registry number 38185-55-6, has the systematic name of 5-bromo-3-chloropyridin-2-amine. Besides this, it is also called 2-Amino-3-chloro-5-bromopyridine. And the chemical formula of this chemical is C5H4BrClN2.
Physical properties of 2-Pyridinamine,5-bromo-3-chloro-: (1)ACD/LogP: 2.74; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3; (4)ACD/LogD (pH 7.4): 3; (5)ACD/BCF (pH 5.5): 71; (6)ACD/BCF (pH 7.4): 71; (7)ACD/KOC (pH 5.5): 733; (8)ACD/KOC (pH 7.4): 733; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 38.91 Å2; (13)Index of Refraction: 1.648; (14)Molar Refractivity: 41.165 cm3; (15)Molar Volume: 113.073 cm3; (16)Polarizability: 16.319×10-24cm3; (17)Surface Tension: 59.181 dyne/cm; (18)Density: 1.835 g/cm3; (19)Flash Point: 94.444 °C; (20)Enthalpy of Vaporization: 46.924 kJ/mol; (21)Boiling Point: 232.551 °C at 760 mmHg; (22)Vapour Pressure: 0.059 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: c1c(cnc(c1Cl)N)Br
(2)InChI: InChI=1/C5H4BrClN2/c6-3-1-4(7)5(8)9-2-3/h1-2H,(H2,8,9)
(3)InChIKey: VXCUGLKQXLPHKI-UHFFFAOYAU
(4)Std. InChI: InChI=1S/C5H4BrClN2/c6-3-1-4(7)5(8)9-2-3/h1-2H,(H2,8,9)
(5)Std. InChIKey: VXCUGLKQXLPHKI-UHFFFAOYSA-N