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CAS No.: | 36953-37-4 |
---|---|
Name: | 4-BROMOPYRIDIN-2-OL |
Article Data: | 6 |
Molecular Structure: | |
Formula: | C5H4BrNO |
Molecular Weight: | 173.997 |
Synonyms: | 2-Hydroxy-4-bromopyridine;4-Bromo-1H-pyridin-2-one;4-Bromo-2(1H)-pyridinone;4-Bromopyridin-2-ol; |
Density: | 1.776 g/cm3 |
Melting Point: | 186 °C |
Boiling Point: | 305.9 °C at 760 mmHg |
Flash Point: | 138.8 °C |
Risk Codes: | 36/38 |
Safety: | 36 |
PSA: | 33.12000 |
LogP: | 1.54970 |
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The 4-Bromo-2-hydroxypyridine is an organic compound with the formula C5H4BrNO. The systematic name of this chemical is 4-bromopyridin-2(1H)-one. With the CAS registry number 36953-37-4, it is also named as 2(1H)-pyridinone, 4-bromo-. The product's categories are Pyridine Series; Pharmacetical; Halides; Pyridines; Pyridine. Besides, it should be stored at room temperature.
Physical properties about 4-Bromo-2-hydroxypyridine are: (1)ACD/LogP: -0.22; (2)ACD/LogD (pH 5.5): 0.03; (3)ACD/LogD (pH 7.4): 0.01; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 14.48; (7)ACD/KOC (pH 7.4): 13.77; (8)#H bond acceptors: 2; (9)#H bond donors: 1; (10)Polar Surface Area: 20.31 Å2; (11)Index of Refraction: 1.6; (12)Molar Refractivity: 33.52 cm3; (13)Molar Volume: 97.9 cm3; (14)Polarizability: 13.29×10-24cm3; (15)Surface Tension: 48.4 dyne/cm; (16)Density: 1.776 g/cm3; (17)Flash Point: 138.8 °C; (18)Enthalpy of Vaporization: 54.64 kJ/mol; (19)Boiling Point: 305.9 °C at 760 mmHg; (20)Vapour Pressure: 0.000796 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: BrC=1\C=C/NC(=O)C=1
(2)InChI: InChI=1/C5H4BrNO/c6-4-1-2-7-5(8)3-4/h1-3H,(H,7,8)
(3)InChIKey: SSLMGOKTIUIZLY-UHFFFAOYAF
(4)Std. InChI: InChI=1S/C5H4BrNO/c6-4-1-2-7-5(8)3-4/h1-3H,(H,7,8)
(5)Std. InChIKey: SSLMGOKTIUIZLY-UHFFFAOYSA-N