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CAS No.: | 23432-42-0 |
---|---|
Name: | 4-HYDROXY-6-NITROQUINOLINE |
Article Data: | 15 |
Molecular Structure: | |
Formula: | C9H6N2O3 |
Molecular Weight: | 190.158 |
Synonyms: | 6-Nitro-4-hydroxyquinoline;6-Nitro-4-quinolinol;NSC 78445; |
EINECS: | -0 |
Density: | 1.419 g/cm3 |
Melting Point: | 325 °C |
Boiling Point: | 362.6 °C at 760 mmHg |
Flash Point: | 173.1 °C |
PSA: | 78.94000 |
LogP: | 2.37180 |
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The 4-Quinolinol, 6-nitro-, with the CAS registry number 23432-42-0, is also known as 4-Hydroxy-6-nitroquinoline. This chemical's molecular formula is C9H6N2O3 and molecular weight is 190.1555. Its systematic name is called 6-nitroquinolin-4(1H)-one.
Physical properties of 4-Quinolinol, 6-nitro-: (1)ACD/LogP: 2.96; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 1.93; (5)ACD/KOC (pH 7.4): 1.9; (6)#H bond acceptors: 5; (7)#H bond donors: 1; (8)#Freely Rotating Bonds: 1; (9)Index of Refraction: 1.636; (10)Molar Refractivity: 48.05 cm3; (11)Molar Volume: 133.9 cm3; (12)Surface Tension: 58.6 dyne/cm; (13)Density: 1.419 g/cm3; (14)Flash Point: 173.1 °C; (15)Enthalpy of Vaporization: 60.86 kJ/mol; (16)Boiling Point: 362.6 °C at 760 mmHg; (17)Vapour Pressure: 1.91E-05 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: [O-][N+](=O)c2ccc1c(C(=O)\C=C/N1)c2
(2)InChI: InChI=1/C9H6N2O3/c12-9-3-4-10-8-2-1-6(11(13)14)5-7(8)9/h1-5H,(H,10,12)
(3)InChIKey: MGCGVNRWZOHFTO-UHFFFAOYAQ