2-Pyridinebutanoic acid (102879-51-6)

The 4-(2-Pyridinyl)butanoic acid with cas registry number of 102879-51-6, has the systematic name of 4-(pyridin-2-yl)butanoic acid. And it is also named 2-pyridinebutanoic acid.

Physical properties about this chemical are: (1)ACD/LogP: 0.93; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 3.42; (6)ACD/KOC (pH 7.4): 1; (7)#H bond acceptors: 3; (8)#H bond donors: 1; (9)#Freely Rotating Bonds: 4; (10)Polar Surface Area: 50.19 Å²; (11)Index of Refraction: 1.537; (12)Molar Refractivity: 44.72 cm³; (13)Molar Volume: 143.1 cm³; (14)Polarizability: 17.72×10^-24cm³; (15)Surface Tension: 49.3 dyne/cm; (16)Enthalpy of Vaporization: 57.44 kJ/mol; (17)Vapour Pressure: 0.000403 mmHg at 25°C.

You can still convert the following datas into molecular structure: 
(1)SMILES: OC(=O)CCCc1ccccn1;
(2)InChI: InChI=1/C9H11NO2/c11-9(12)6-3-5-8-4-1-2-7-10-8/h1-2,4,7H,3,5-6H2,(H,11,12);
(3)InChIKey: HUWVYTTVLDALOP-UHFFFAOYAK;
(4)Std. InChI: InChI=1S/C9H11NO2/c11-9(12)6-3-5-8-4-1-2-7-10-8/h1-2,4,7H,3,5-6H2,(H,11,12);
(5)Std. InChIKey: HUWVYTTVLDALOP-UHFFFAOYSA-N