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2-Chloro-6-hydroxyisonicotinamide

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Name

2-Chloro-6-hydroxyisonicotinamide

EINECS N/A
CAS No. 182483-97-2 Density 1.544 g/cm3
PSA 76.21000 LogP 1.23980
Solubility N/A Melting Point N/A
Formula C6H5ClN2O2 Boiling Point 409.9 °C at 760 mmHg
Molecular Weight 172.57 Flash Point 201.7 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 182483-97-2 (2-HYDROXY-6-CHLOROPYRIDINE-4-CARBOXAMIDE) Hazard Symbols N/A
Synonyms

4-Pyridinecarboxamide, 2-chloro-6-hydroxy-;

 

2-Chloro-6-hydroxyisonicotinamide Specification

The 2-Chloro-6-hydroxyisonicotinamide, with the CAS registry number 182483-97-2, is also known as 4-Pyridinecarboxamide, 2-chloro-6-hydroxy-. This chemical's molecular formula is C6H5ClN2O2 and molecular weight is 172.57. What's more, its systematic name is 2-Chloro-6-hydroxypyridine-4-carboxamide. 

Physical properties about 2-Chloro-6-hydroxyisonicotinamide are: (1)# of Rule of 5 Violations: 0; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 20.17; (5)ACD/KOC (pH 7.4): 4.73; (6)#H bond acceptors: 4; (7)#H bond donors: 3; (8)#Freely Rotating Bonds: 1; (9)Polar Surface Area: 76.21 Å2; (10)Index of Refraction: 1.635; (11)Molar Refractivity: 40.05 cm3; (12)Molar Volume: 111.7 cm3; (13)Polarizability: 15.87×10-24 cm3; (14)Surface Tension: 73.1 dyne/cm; (15)Density: 1.544 g/cm3; (16)Flash Point: 201.7 °C; (17)Enthalpy of Vaporization: 68.79 kJ/mol; (18)Boiling Point: 409.9 °C at 760 mmHg; (19)Vapour Pressure: 2.64E-07 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O=C(N)c1cc(O)nc(Cl)c1
(2) InChI: InChI=1/C6H5ClN2O2/c7-4-1-3(6(8)11)2-5(10)9-4/h1-2H,(H2,8,11)(H,9,10)
(3) InChIKey: WVGAIBCNLHQTSH-UHFFFAOYAM

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