HYDROCINCHONINE

The Cinchonan-9-ol,10,11-dihydro-, (9S)- with CAS registry number of 485-65-4 is also known as Hydrocinchonine(6CI,7CI,8CI). The IUPAC name is (5-Ethyl-1-azabicyclo[2.2.2]octan-2-yl)-quinolin-4-ylmethanol. Its EINECS registry number is 207-621-8. In addition, the formula is C₁₉H₂₄N₂O and the molecular weight is 296.41. This chemical is stable at normal temperature and pressure, and it should be sealed in ventilated and dry place.

Physical properties about Cinchonan-9-ol,10,11-dihydro-, (9S)- are: (1)ACD/LogP: 3.21; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1; (4)ACD/LogD (pH 7.4): 1; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 2; (7)ACD/KOC (pH 5.5): 2; (8)ACD/KOC (pH 7.4): 10; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 36.36Ų; (13)Index of Refraction: 1.639; (14)Molar Refractivity: 89.655 cm³; (15)Molar Volume: 249.251 cm³; (16)Polarizability: 35.542×10^-24cm³; (17)Surface Tension: 55.715 dyne/cm; (18)Density: 1.189 g/cm³; (19)Flash Point: 236.309 °C; (20)Enthalpy of Vaporization: 76.81 kJ/mol; (21)Boiling Point: 467.126 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25 °C.

When you are using this chemical, please be cautious about it. As a chemical, it is harmful by inhalation, in contact with skin and if swallowed. During using it, wear suitable protective clothing and gloves.

You can still convert the following datas into molecular structure:
1. SMILES: n2c1c(cccc1)c(cc2)[C@H](O)[C@@H]3N4CC[C@@H](C3)[C@@H](CC)C4
2. InChI: InChI=1/C19H24N2O/c1-2-13-12-21-10-8-14(13)11-18(21)19(22)16-7-9-20-17-6-4-3-5-15(16)17/h3-7,9,13-14,18-19,22H,2,8,10-12H2,1H3/t13-,14-,18+,19-/m0/s
3. InChIKey: WFJNHVWTKZUUTR-QAMTZSDWBA
4. Std. InChI: InChI=1S/C19H24N2O/c1-2-13-12-21-10-8-14(13)11-18(21)19(22)16-7-9-20-17-6-4-3-5-15(16)17/h3-7,9,13-14,18-19,22H,2,8,10-12H2,1H3/t13-,14-,18+,19-/m0/s1
5. Std. InChIKey: WFJNHVWTKZUUTR-QAMTZSDWSA-N