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CAS No.: | 130115-85-4 |
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Name: | 2-Chloro-3-Bromo-5-Hydroxypyridine |
Article Data: | 4 |
Molecular Structure: | |
Formula: | C5H3BrClNO |
Molecular Weight: | 208.442 |
Synonyms: | 3-Bromo-2-chloro-5-hydroxypyridine;3-Bromo-2-chloropyridin-5-ol;5-Bromo-6-chloro-3-pyridinol; |
EINECS: | -0 |
Density: | 1.908 g/cm3 |
Boiling Point: | 388.608 °C at 760 mmHg |
Flash Point: | 188.824 °C |
PSA: | 33.12000 |
LogP: | 2.20310 |
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The CAS register number of 2-Chloro-3-bromo-5-hydroxypyridine is 130115-85-4. It also can be called as 3-Bromo-2-chloro-5-hydroxypyridine and the IUPAC name about this chemical is 5-bromo-6-chloropyridin-3-ol. The molecular formula about this chemical is C5H3BrClNO and molecular weight is 208.44. It belongs to the Pyridine.
Physical properties about 2-Chloro-3-bromo-5-hydroxypyridine are: (1)ACD/LogP: 1.81; (2)ACD/LogD (pH 5.5): 3; (3)ACD/LogD (pH 7.4): 2; (4)ACD/BCF (pH 5.5): 103; (5)ACD/BCF (pH 7.4): 27; (6)ACD/KOC (pH 5.5): 950; (7)ACD/KOC (pH 7.4): 253; (8)#H bond acceptors: 2; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 1; (11)Polar Surface Area: 33.12Å2; (12)Index of Refraction: 1.629; (13)Molar Refractivity: 38.811 cm3; (14)Molar Volume: 109.223 cm3; (15)Polarizability: 15.386x10-24cm3; (16)Surface Tension: 59.07 dyne/cm; (17)Enthalpy of Vaporization: 66.277 kJ/mol; (18)Boiling Point: 388.608 °C at 760 mmHg.
You can still convert the following datas into molecular structure:
(1)SMILES: Oc1cnc(Cl)c(Br)c1
(2)InChI: InChI=1/C5H3BrClNO/c6-4-1-3(9)2-8-5(4)7/h1-2,9H
(3)InChIKey: XUROMMQAFZTGAW-UHFFFAOYAG
(4)Std. InChI: InChI=1S/C5H3BrClNO/c6-4-1-3(9)2-8-5(4)7/h1-2,9H
(5)Std. InChIKey: XUROMMQAFZTGAW-UHFFFAOYSA-N