Name: 8-HYDROXYQUINOLINE-2-CARBONITRILE
SKU: 6759-78-0

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Basic Information

Molecular Structure:
CAS No.:	6759-78-0
Name:	8-HYDROXYQUINOLINE-2-CARBONITRILE

Formula:	C₁₀H₆N₂O
Molecular Weight:	170.17
Synonyms:	Quinaldonitrile,8-hydroxy- (7CI,8CI);2-Cyano-8-hydroxyquinoline;2-Cyanoquinolin-8-ol;8-Hydroxy-2-quinolinecarbonitrile;
Density:	1.36 g/cm³
Melting Point:	133-136 °C
Boiling Point:	402.7 °C at 760 mmHg
Flash Point:	197.3 °C
Appearance:	yellow to brown crystalline powder
Hazard Symbols:	Xi
Risk Codes:	36/37/38
Safety:	26-36
Transport Information:	UN3439
PSA:	56.91000
LogP:	1.81208

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Specification

The 2-Quinolinecarbonitrile,8-hydroxy-, with the CAS registry number 6759-78-0, is also known as 8-Hydroxyquinaldonitrile. It belongs to the product category of Quinolines, Quinazolines and Derivatives. This chemical's molecular formula is C₁₀H₆N₂O and molecular weight is 170.16744. Its IUPAC name is called 8-hydroxyquinoline-2-carbonitrile. This chemical is yellow to brown crystalline powder.

Physical properties of 2-Quinolinecarbonitrile,8-hydroxy-: (1)ACD/LogP: 1.39; (2)ACD/LogD (pH 5.5): 1.35; (3)ACD/LogD (pH 7.4): 1.32; (4)ACD/BCF (pH 5.5): 6.18; (5)ACD/BCF (pH 7.4): 5.66; (6)ACD/KOC (pH 5.5): 125.47; (7)ACD/KOC (pH 7.4): 114.87; (8)#H bond acceptors: 3; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 1; (11)Index of Refraction: 1.702; (12)Molar Refractivity: 48.2 cm³; (13)Molar Volume: 124.4 cm³; (14)Surface Tension: 77.1 dyne/cm; (15)Density: 1.36 g/cm³; (16)Flash Point: 197.3 °C; (17)Enthalpy of Vaporization: 67.94 kJ/mol; (18)Boiling Point: 402.7 °C at 760 mmHg; (19)Vapour Pressure: 4.62E-07 mmHg at 25°C.

Uses of 2-Quinolinecarbonitrile,8-hydroxy-: it can be used to produce 8-hydroxy-quinoline-2-carboxylic acid by heating. This reaction will need reagent NaOH and solvent H₂O with reaction time of 4 hours. The yield is about 70%.

When you are using this chemical, please be cautious about it as the following:
This chemical may cause inflammation to the skin or other mucous membranes. It is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. Whenever you will contact it, please wear suitable protective clothing.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CC2=C(C(=C1)O)N=C(C=C2)C#N
(2)InChI: InChI=1S/C10H6N2O/c11-6-8-5-4-7-2-1-3-9(13)10(7)12-8/h1-5,13H
(3)InChIKey: KUQKKIBQVSFDHX-UHFFFAOYSA-N