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1,2,5,6,7,8-Hexahydroquinoline-2,5-dione

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Name

1,2,5,6,7,8-Hexahydroquinoline-2,5-dione

EINECS N/A
CAS No. 15450-69-8 Density 1.271 g/cm3
PSA 49.93000 LogP 0.89390
Solubility N/A Melting Point 294 °C(Solv: ethanol (64-17-5))
Formula C9H9NO2 Boiling Point 412.342 °C at 760 mmHg
Molecular Weight 163.176 Flash Point 200.084 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 15450-69-8 (1,2,5,6,7,8-Hexahydroquinoline-2,5-dione) Hazard Symbols N/A
Synonyms

7,8-Dihydro-1H,6H-quinoline-2,5-dione;7,8-Dihydroquinoline-2,5(1H,6H)-dione;NSC 106699;SF 39;

Article Data 22

1,2,5,6,7,8-Hexahydroquinoline-2,5-dione Specification

The 2,5(1H,6H)-Quinolinedione,7,8-dihydro- is an organic compound with the formula C9H9NO2. The IUPAC name of this chemical is 1,6,7,8-Tetrahydroquinoline-2,5-dione. With the CAS registry number 15450-69-8, it is also named as 7,8-Dihydroquinoline-2,5(1H,6H)-dione. The product's category is Pharmacetical. Besides, its molecular weight is 163.17.

Physical properties about 2,5(1H,6H)-Quinolinedione,7,8-dihydro- are: (1)ACD/LogP: -0.66; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 10.48; (5)ACD/KOC (pH 7.4): 10.48; (6)#H bond acceptors: 3; (7)#H bond donors: 1; (8)Polar Surface Area: 37.38 Å2; (9)Index of Refraction: 1.582; (10)Molar Refractivity: 42.87 cm3; (11)Molar Volume: 128.3 cm3; (12)Polarizability: 16.99×10-24 cm3; (13)Surface Tension: 47.9 dyne/cm; (14)Density: 1.27 g/cm3; (15)Flash Point: 200.1 °C; (16)Enthalpy of Vaporization: 66.5 kJ/mol; (17)Boiling Point: 412.3 °C at 760 mmHg; (18)Vapour Pressure: 5.22E-07 mmHg at 25 °C. 

You can still convert the following datas into molecular structure:
(1)InChI: InChI=1/C9H9NO2/c11-8-3-1-2-7-6(8)4-5-9(12)10-7/h4-5H,1-3H2,(H,10,12)
(2)InChIKey: AUMQUQJTKCJMPA-UHFFFAOYAV
(3)Std. InChI: InChI=1S/C9H9NO2/c11-8-3-1-2-7-6(8)4-5-9(12)10-7/h4-5H,1-3H2,(H,10,12)
(4)Std. InChIKey: AUMQUQJTKCJMPA-UHFFFAOYSA-N

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