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CAS No.: | 6602-33-1 |
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Name: | 2,6-DIBROMO-3-HYDROXYPYRIDINE |
Article Data: | 19 |
Molecular Structure: | |
Formula: | C5H3Br2NO |
Molecular Weight: | 252.893 |
Synonyms: | 2,6-Dibromo-3-hydroxypyridine; |
EINECS: | 229-548-0 |
Density: | 2.228 g/cm3 |
Melting Point: | 164.0 to 168.0 °C |
Boiling Point: | 369.3 °C at 760 mmHg |
Flash Point: | 177.1 °C |
PSA: | 33.12000 |
LogP: | 2.31220 |
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The CAS register number of 2,6-Dibromopyridin-3-ol is 6602-33-1. It also can be called as 2,6-Dibromo-3-hydroxypyridine. The molecular formula about this chemical is C5H3Br2NO and the molecular weight is 252.89. It belongs to the following product categorie which include Pharmaceti.
Physical properties about 2,6-Dibromopyridin-3-ol are: (1)ACD/LogP: 2.66; (2)ACD/LogD (pH 5.5): 2.58; (3)ACD/LogD (pH 7.4): 1.43; (4)ACD/BCF (pH 5.5): 51.08; (5)ACD/BCF (pH 7.4): 3.63; (6)ACD/KOC (pH 5.5): 551.59; (7)ACD/KOC (pH 7.4): 39.24; (8)#H bond acceptors: 2; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 1; (11)Polar Surface Area: 22.12 Å2; (12)Index of Refraction: 1.654; (13)Molar Refractivity: 41.6 cm3; (14)Molar Volume: 113.4 cm3; (15)Polarizability: 16.49x10-24cm3; (16)Surface Tension: 61.2 dyne/cm; (17)Density: 2.228 g/cm3; (18)Flash Point: 177.1 °C; (19)Enthalpy of Vaporization: 64.03 kJ/mol; (20)Boiling Point: 369.3 °C at 760 mmHg; (21)Vapour Pressure: 5.64E-06 mmHg at 25 °C.
Preparation: this chemical can be prepared by pyridin-3-ol. This reaction will need reagent of pyridine and bromine.
Uses of 2,6-Dibromopyridin-3-ol: it can be used to produce 2,6-dibromo-3-pyridinyl 3-methyl-2-butenyl ether with 1-bromo-3-methyl-but-2-ene. This reaction needs heating. This reaction will need reagent of K2CO3 and solvent of acetone. The reaction time is 1.5 hours. The yield is about 92%.
You can still convert the following datas into molecular structure:
(1)SMILES: Brc1nc(Br)c(O)cc1
(2)InChI: InChI=1/C5H3Br2NO/c6-4-2-1-3(9)5(7)8-4/h1-2,9H
(3)InChIKey: RKOLKIWJSXSHLV-UHFFFAOYAS
(4)Std. InChI: InChI=1S/C5H3Br2NO/c6-4-2-1-3(9)5(7)8-4/h1-2,9H
(5)Std. InChIKey: RKOLKIWJSXSHLV-UHFFFAOYSA-N