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7-Methoxy-1,2,3,4-tetrahydroisoquinolin-6-ol

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Name

7-Methoxy-1,2,3,4-tetrahydroisoquinolin-6-ol

EINECS N/A
CAS No. 1011-43-4 Density 1.158 g/cm3
PSA 41.49000 LogP 1.37530
Solubility N/A Melting Point N/A
Formula C10H13NO2 Boiling Point 344.353 °C at 760 mmHg
Molecular Weight 179.219 Flash Point 162.059 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 1011-43-4 (m90102) Hazard Symbols N/A
Synonyms

7-Methoxy-1,2,3,4-tetrahydro-6-isoquinolinol;7-Methoxy-6-hydroxy-1,2,3,4-tetrahydroisoquinoline;7-O-Methylnorsalsolinol;

 

7-Methoxy-1,2,3,4-tetrahydroisoquinolin-6-ol Specification

The 7-Methoxy-1,2,3,4-tetrahydroisoquinolin-6-ol, with the CAS registry number 1011-43-4, is also known as 7-Methoxy-6-hydroxy-1,2,3,4-tetrahydroisoquinoline. This chemical's molecular formula is C10H13NO2 and molecular weight is 179.22. What's more, its systematic name is 7-Methoxy-1,2,3,4-tetrahydro-6-isoquinolinol.

Physical properties of 7-Methoxy-1,2,3,4-tetrahydroisoquinolin-6-ol are: (1)ACD/LogP: 0.705; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -2.32; (4)ACD/LogD (pH 7.4): -1.23; (5)ACD/BCF (pH 5.5): 1.00; (6)ACD/BCF (pH 7.4): 1.00; (7)ACD/KOC (pH 5.5): 1.00; (8)ACD/KOC (pH 7.4): 1.00; (9)#H bond acceptors: 3; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 41.49 Å2; (13)Index of Refraction: 1.564; (14)Molar Refractivity: 50.335 cm3; (15)Molar Volume: 154.728 cm3; (16)Polarizability: 19.955×10-24cm3; (17)Surface Tension: 43.8 dyne/cm; (18)Density: 1.158 g/cm3; (19)Flash Point: 162.059 °C; (20)Enthalpy of Vaporization: 61.158 kJ/mol; (21)Boiling Point: 344.353 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O(c1c(O)cc2c(c1)CNCC2)C
(2)Std. InChI: InChI=1S/C10H13NO2/c1-13-10-5-8-6-11-3-2-7(8)4-9(10)12/h4-5,11-12H,2-3,6H2,1H3
(3)Std. InChIKey: MHTLPFVHBVOGMZ-UHFFFAOYSA-N

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