7-Isoquinolinol,1,2,3,4-tetrahydro- (30798-64-2)

The 1,2,3,4-Tetrahydroisoquinolin-7-ol with the CAS number 30798-64-2 is also called 7-Isoquinolinol,1,2,3,4-tetrahydro-. Its molecular formula is C₉H₁₁NO. This chemical is a kind of organics. It should be stored in dry and cool environment.

The properties of the 1,2,3,4-Tetrahydroisoquinolin-7-ol are: (1)ACD/LogP: 0.67; (2)# of Rule of 5 Violations: 0 ; (3)#H bond acceptors: 2; (4)#H bond donors: 2; (5)#Freely Rotating Bonds: 1; (6)Polar Surface Area: 12.47Ų; (7)Index of Refraction: 1.582; (8)Molar Refractivity: 43.65 cm³; (9)Molar Volume: 130.7 cm³; (10)Polarizability: 17.3×10^-24cm³; (11)Surface Tension: 46.4 dyne/cm; (12)Enthalpy of Vaporization: 57.66 kJ/mol; (13)Vapour Pressure: 0.000269 mmHg at 25°C.

Preparation: This chemical can be prepared by isoquinolin-7-ol. This reaction needs reagent platinum and acetic acid. This reaction needs Hydrogenation.

Uses: This chemical can react with di(tert-butyl) carbonate to prepare 7-hydroxy-3,4-dihydro-1H-isoquinoline-2-carboxylic acid tert-butyl ester. This reaction needs reagent Et₃N and solvent CH₂Cl₂ at temperature of 5 °C. The reaction time is 1.0 hour. The yield is 89%.

You can still convert the following datas into molecular structure:
(1)SMILES: Oc1ccc2c(c1)CNCC2
(2)InChI: InChI=1/C9H11NO/c11-9-2-1-7-3-4-10-6-8(7)5-9/h1-2,5,10-11H,3-4,6H2
(3)InChIKey: RADQTHXRZJGDQI-UHFFFAOYAI