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CAS No.: | 215872-62-1 |
---|---|
Name: | 1H-Imidazole-5-methanol,1-ethyl-(9CI) |
Article Data: | 4 |
Molecular Structure: | |
Formula: | C6H10N2O |
Molecular Weight: | 126.158 |
Synonyms: | (1-ethyl-1H-imidazol-5-yl)methanol; |
Density: | 1.12 g/cm3 |
Boiling Point: | 321.9 °C at 760 mmHg |
Flash Point: | 148.5 °C |
PSA: | 38.05000 |
LogP: | 0.39530 |
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The 1H-Imidazole-5-methanol,1-ethyl-, with the CAS registry number 215872-62-1, has the systematic name of (1-ethyl-1H-imidazol-5-yl)methanol. It belongs to the product category of Aminetertiary. And the molecular formula of this chemical is C6H10N2O.
The physical properties of 1H-Imidazole-5-methanol,1-ethyl- are as following: (1)# of Rule of 5 Violations: 0; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 1; (5)ACD/KOC (pH 7.4): 6.77; (6)#H bond acceptors: 3; (7)#H bond donors: 1; (8)#Freely Rotating Bonds: 3; (9)Polar Surface Area: 38.05 Å2; (10)Index of Refraction: 1.541; (11)Molar Refractivity: 35.32 cm3; (12)Molar Volume: 112.2 cm3; (13)Polarizability: 14×10-24cm3; (14)Surface Tension: 40.5 dyne/cm; (15)Density: 1.12 g/cm3; (16)Flash Point: 148.5 °C; (17)Enthalpy of Vaporization: 59.51 kJ/mol; (18)Boiling Point: 321.9 °C at 760 mmHg; (19)Vapour Pressure: 0.000119 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: OCc1cncn1CC
(2)InChI: InChI=1/C6H10N2O/c1-2-8-5-7-3-6(8)4-9/h3,5,9H,2,4H2,1H3
(3)InChIKey: FRNCAMZAPFINSG-UHFFFAOYAG