3-Pyridinecarboxaldehyde,2-(4-morpholinyl)- (465514-09-4)

The 2-Morpholinopyridine-3-carboxaldehyde with cas registry number of 465514-09-4, whose systematic name is 2-morpholin-4-ylpyridine-3-carbaldehyde. Its raw materials are Hydrochloric acid-->Ethyl acetate-->Tetrahydrofuran-->Sodium-->N,N-Dimethylformamide-->Sodium sulfate-->Magnesium sulfate-->Triethylamine-->Ammonium hydroxide-->Sodium chloride-->n-Butyllithium-->Hexane-->Nitrogen-->Ammonium chloride -->1-Oxa-4-azacyclohexane-->Diisopropylamine-->2-Chloropyridine-->1,3-Dimethyl-3,4,5,6-tetrahydro-2(1H)-pyrimidinone.

Physical properties about this chemical are: (1)ACD/LogP: -0.14; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.99; (4)ACD/LogD (pH 7.4): -0.17; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 2.78; (8)ACD/KOC (pH 7.4): 18.6; (9)#H bond acceptors: 4; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 42.43 Å²; (13)Index of Refraction: 1.586; (14)Molar Refractivity: 52.9 cm³; (15)Molar Volume: 157.6 cm³; (16)Polarizability: 20.97×10^-24cm³; (17)Surface Tension: 52.2 dyne/cm; (18)Enthalpy of Vaporization: 61.8 kJ/mol; (19)Vapour Pressure: 1.06E-05 mmHg at 25°C.

You can still convert the following datas into molecular structure: 
(1)SMILES:O=Cc1c(nccc1)N2CCOCC2;
(2)InChI:InChI=1/C10H12N2O2/c13-8-9-2-1-3-11-10(9)12-4-6-14-7-5-12/h1-3,8H,4-7H2;
(3)InChIKey:CCPVZIBHRFCNTR-UHFFFAOYAB;
(4)Std. InChI:InChI=1S/C10H12N2O2/c13-8-9-2-1-3-11-10(9)12-4-6-14-7-5-12/h1-3,8H,4-7H2;
(5)Std. InChIKey:CCPVZIBHRFCNTR-UHFFFAOYSA-N.