2-Chloro-8-quinolinecarboxylic acid (1092287-54-1)

The systematic name of 2-Chloro-8-quinolinecarboxylic acid is 2-chloroquinoline-8-carboxylic acid. With the CAS registry number 1092287-54-1, it is also named as 2-chloroquinoline-8-carboxylic acid. The product's molecular formula is C₁₀H₆ClNO₂ and its molecular weight is 207.61. 

The other characteristics of 2-Chloro-8-quinolinecarboxylic acid can be summarized as: (1)ACD/LogP: 2.39; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.25; (4)ACD/LogD (pH 7.4): ; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 3.47; (8)ACD/KOC (pH 7.4): 1; (9)H bond acceptors: 3; (10)H bond donors: 1; (11)Freely Rotating Bonds: 1; (12)Polar Surface Area: 50.19 Å²; (13)Index of Refraction: 1.69; (14)Molar Refractivity: 54.01 cm³; (15)Molar Volume: 141.2 cm³; (16)Polarizability: 21.41×10^-24cm³; (17)Surface Tension: 66.4 dyne/cm; (18)Density: 1.469 g/cm³; (19)Flash Point: 202.9 °C; (20)Enthalpy of Vaporization: 70.06 kJ/mol; (21)Boiling Point: 411.9 °C at 760 mmHg; (22)Vapour Pressure: 1.59E-07 mmHg at 25 °C.

People can use the following data to convert to the molecule structure.
(1)SMILES:OC(=O)c1cccc2ccc(Cl)nc12
(2)InChI:InChI=1/C10H6ClNO2/c11-8-5-4-6-2-1-3-7(10(13)14)9(6)12-8/h1-5H,(H,13,14)
(3)InChIKey:MDJCCDPEWOWYIJ-UHFFFAOYAE
(4)Std. InChI:InChI=1S/C10H6ClNO2/c11-8-5-4-6-2-1-3-7(10(13)14)9(6)12-8/h1-5H,(H,13,14)
(5)Std. InChIKey:MDJCCDPEWOWYIJ-UHFFFAOYSA-N