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Quinoline,5,6-dimethyl-8-nitro-

  • Name Quinoline,5,6-dimethyl-8-nitro-
  • EINECS271-275-4
  • CAS No. 68527-68-4
  • Density1.254 g/cm3
  • PSA58.71000
  • LogP3.28300
  • SolubilityN/A
  • Melting PointN/A
  • FormulaC11H10N2O2
  • Boiling Point377.4 °C at 760 mmHg
  • Molecular Weight202.213
  • Flash Point182 °C
  • Transport InformationN/A
  • AppearanceN/A
  • Safety
  • Risk CodesN/A
  • Molecular Structure
    Molecular Structure of 68527-68-4 (5,6-dimethyl-8-nitroquinoline)
  • Hazard SymbolsN/A
  • SynonymsN/A
  • Article Data4

Quinoline,5,6-dimethyl-8-nitro- Specification

The CAS register number of Quinoline,5,6-dimethyl-8-nitro- is 68527-68-4. The systematic name about this chemical is 5,6-dimethyl-8-nitroquinoline. The molecular formula about this chemical is C11H10N2O2 and the molecular weight is 202.2093.

Physical properties about Quinoline,5,6-dimethyl-8-nitro- are: (1)ACD/LogP: 2.39; (2)ACD/LogD (pH 5.5): 2.39; (3)ACD/LogD (pH 7.4): 2.39; (4)ACD/BCF (pH 5.5): 38.51; (5)ACD/BCF (pH 7.4): 38.51; (6)ACD/KOC (pH 5.5): 474.82; (7)ACD/KOC (pH 7.4): 474.89; (8)#H bond acceptors: 4; (9)#Freely Rotating Bonds: 1; (10)Polar Surface Area: 58.71 Å2; (11)Index of Refraction: 1.644; (12)Molar Refractivity: 58.38 cm3; (13)Molar Volume: 161.1 cm3; (14)Polarizability: 23.14x10-24cm3; (15)Surface Tension: 53.5 dyne/cm; (16)Density: 1.254 g/cm3; (17)Flash Point: 182 °C; (18)Enthalpy of Vaporization: 60.06 kJ/mol; (19)Boiling Point: 377.4 °C at 760 mmHg; (20)Vapour Pressure: 1.47E-05 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)SMILES: [O-][N+](=O)c1cc(c(c2cccnc12)C)C
(2)InChI: InChI=1/C11H10N2O2/c1-7-6-10(13(14)15)11-9(8(7)2)4-3-5-12-11/h3-6H,1-2H3
(3)InChIKey: XFLPCFACRGFFQN-UHFFFAOYAY
(4)Std. InChI: InChI=1S/C11H10N2O2/c1-7-6-10(13(14)15)11-9(8(7)2)4-3-5-12-11/h3-6H,1-2H3
(5)Std. InChIKey: XFLPCFACRGFFQN-UHFFFAOYSA-N

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