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2-Bromo-5-hydroxy-3-picoline

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Name

2-Bromo-5-hydroxy-3-picoline

EINECS N/A
CAS No. 1003711-43-0 Density 1.655 g/cm3
PSA 33.12000 LogP 1.85810
Solubility N/A Melting Point N/A
Formula C6H6BrNO Boiling Point 377.2 °C at 760 mmHg
Molecular Weight 188.024 Flash Point 181.9 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 1003711-43-0 (2-Bromo-5-hydroxy-3-methylpyridine) Hazard Symbols N/A
Synonyms

2-Bromo-5-hydroxy-3-picoline;6-Bromo-5-methylpyridin-3-ol;

 

2-Bromo-5-hydroxy-3-picoline Specification

The 2-Bromo-5-hydroxy-3-picoline with the cas number 1003711-43-0 is also called 6-Bromo-5-methylpyridin-3-ol. The systematic name is 3-pyridinol, 6-bromo-5-methyl-. Its molecular formula is C6H6BrNO. This chemical is a kind of organics. It should be stored in dry and cool environment.

The properties of the chemical are: (1)ACD/LogP: 2.14; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.14; (4)ACD/LogD (pH 7.4): 2.02; (5)ACD/BCF (pH 5.5): 24.84; (6)ACD/BCF (pH 7.4): 18.81; (7)ACD/KOC (pH 5.5): 346.52; (8)ACD/KOC (pH 7.4): 262.47; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 33.12 Å2; (13)Index of Refraction: 1.598; (14)Molar Refractivity: 38.74 cm3; (15)Molar Volume: 113.5 cm3; (16)Polarizability: 15.35×10-24cm3; (17)Surface Tension: 51.7 dyne/cm; (18)Enthalpy of Vaporization: 64.95 kJ/mol; (19)Vapour Pressure: 3.16×10-6 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Cc1cc(cnc1Br)O
(2)InChI: InChI=1/C6H6BrNO/c1-4-2-5(9)3-8-6(4)7/h2-3,9H,1H3
(3)InChIKey: KCCYUVIIKCPVDH-UHFFFAOYAA

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