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| CAS No.: | 913836-16-5 |
|---|---|
| Name: | 5-BROMO-2-HYDROXY-4-PYRIDINECARBOXYLIC ACID |
| Article Data: | 2 |
| Molecular Structure: | |
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| Formula: | C6H4BrNO3 |
| Molecular Weight: | 218.007 |
| Synonyms: | 5-bromo-2-oxo-1H-pyridine-4-carboxylic acid |
| EINECS: | 251-156-6 |
| Density: | 1.985 g/cm3 |
| Melting Point: | 258-262 |
| Boiling Point: | 550.1 °C at 760 mmHg |
| Flash Point: | 286.5 °C |
| Hazard Symbols: |
 Xi
|
| PSA: | 70.42000 |
| LogP: | 1.24790 |
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- 926293-55-26-Bromo-2-methylpyridine-3-carboxaldehyde
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- 945683-37-41-butyl-2,3-dimethylimidazolium octanesulfate
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- Total:30 Page 1 of 1 1
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Specification
The 5-Bromo-2-hydroxyisonicotinic acid is an organic compound with the formula C6H4BrNO3. The systematic name of this chemical is 5-bromo-2-hydroxy-pyridine-4-carboxylic acid. With the CAS registry number 913836-16-5, it is also named as 4-pyridinecarboxylic acid, 5-bromo-2-hydroxy-. The product's categories are Blocks; Pyridines.
Physical properties about 5-Bromo-2-hydroxyisonicotinic acid are: (1)ACD/LogP: 0.25; (2)#H bond acceptors: 4; (3)#H bond donors: 2; (4)#Freely Rotating Bonds: 1; (5)Polar Surface Area: 70.42 Å2; (6)Index of Refraction: 1.666; (7)Molar Refractivity: 40.84 cm3; (8)Molar Volume: 109.8 cm3; (9)Polarizability: 16.19×10-24cm3; (10)Surface Tension: 80.6 dyne/cm; (11)Density: 1.985 g/cm3; (12)Flash Point: 286.5 °C; (13)Enthalpy of Vaporization: 87.36 kJ/mol; (14)Boiling Point: 550.1 °C at 760 mmHg; (15)Vapour Pressure: 6.16E-13 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: c1c(c(cnc1O)Br)C(=O)O
(2)InChI: InChI=1/C6H4BrNO3/c7-4-2-8-5(9)1-3(4)6(10)11/h1-2H,(H,8,9)(H,10,11)
(3)InChIKey:SXQBUACWNOVEDX-UHFFFAOYAT
(4)Std. InChI: InChI=1S/C6H4BrNO3/c7-4-2-8-5(9)1-3(4)6(10)11/h1-2H,(H,8,9)(H,10,11)
(5)Std. InChIKey: SXQBUACWNOVEDX-UHFFFAOYSA-N