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CAS No.: | 237405-39-9 |
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Name: | 3H-Imidazo[4,5-b]pyridine-3-ethanol |
Molecular Structure: | |
Formula: | C8H9N3O |
Molecular Weight: | 163.18 |
Synonyms: | 3H-Imidazo[4,5-b]pyridine-3-ethanol;2-(3H-iMidazo[4,5-b]pyridin-3-yl)ethanol |
Density: | 1.34 g/cm3 |
Boiling Point: | 364.661 °C at 760 mmHg |
Flash Point: | 174.341 °C |
PSA: | 50.94000 |
LogP: | 0.42360 |
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The 3H-Imidazo[4,5-b]pyridine-3-ethanol is an organic compound with the formula C8H9N3O. With the CAS registry number 237405-39-9, the systematic name of this chemical is 2-(3H-imidazo[4,5-b]pyridin-3-yl)ethanol.
Physical properties about 3H-Imidazo[4,5-b]pyridine-3-ethanol are: (1)ACD/LogP: -0.53; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 14; (5)ACD/KOC (pH 7.4): 15; (6)#H bond acceptors: 4; (7)#H bond donors: 1; (8)#Freely Rotating Bonds: 3; (9)Polar Surface Area: 50.94 Å2; (10)Index of Refraction: 1.665; (11)Molar Refractivity: 45.229 cm3; (12)Molar Volume: 121.745 cm3; (13)Polarizability: 17.93×10-24cm3; (14)Surface Tension: 55.932 dyne/cm; (15)Density: 1.34 g/cm3; (16)Flash Point: 174.341 °C; (17)Enthalpy of Vaporization: 64.451 kJ/mol; (18)Boiling Point: 364.661 °C at 760 mmHg.
You can still convert the following datas into molecular structure:
(1)SMILES: OCCn2cnc1cccnc12
(2)InChI: InChI=1/C8H9N3O/c12-5-4-11-6-10-7-2-1-3-9-8(7)11/h1-3,6,12H,4-5H2
(3)InChIKey: NKUQOMMHRNBLOR-UHFFFAOYAS
(4)Std. InChI: InChI=1S/C8H9N3O/c12-5-4-11-6-10-7-2-1-3-9-8(7)11/h1-3,6,12H,4-5H2
(5)Std. InChIKey: NKUQOMMHRNBLOR-UHFFFAOYSA-N