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36953-37-4

Basic Information
CAS No.: 36953-37-4
Name: 4-BROMOPYRIDIN-2-OL
Article Data: 6
Molecular Structure:
Molecular Structure of 36953-37-4 (4-BROMOPYRIDIN-2-OL)
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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Specification

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