CAS No.1615-15-2,1-(2-HYDROXYETHYL)-2-METHYLIMIDAZOLE Suppliers

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Basic Information

Molecular Structure:
CAS No.:	1615-15-2
Name:	1-(2-HYDROXYETHYL)-2-METHYLIMIDAZOLE
Article Data:	2

Formula:	C₆H₁₀N₂O
Molecular Weight:	126.158
Synonyms:	Imidazole-1-ethanol,2-methyl- (6CI,7CI,8CI);1-(2-Hydroxyethyl)-2-methylimidazole;1-(2'-Hydroxyethyl)-2-methylimidazole;1-(b-Hydroxyethyl)-2-methylimidazole;
Density:	1.12 g/cm³
Melting Point:	63-65 °C(Solv: ethyl acetate (141-78-6))
Boiling Point:	298.5 °C at 760 mmHg
Flash Point:	134.3 °C
Hazard Symbols:	Xn
Risk Codes:	22-41
Safety:	26-39
PSA:	38.05000
LogP:	0.18380

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Specification

The 1H-Imidazole-1-ethanol,2-methyl-, with the CAS registry number 1615-15-2, is also known as 1-(2-Hydroxyethyl)-2-methylimidazole. This chemical's molecular formula is C₆H₁₀N₂O and molecular weight is 126.16. What's more, its IUPAC name is 2-(2-Methylimidazol-1-yl)ethanol.

Physical properties about 1H-Imidazole-1-ethanol,2-methyl-: (1)ACD/LogP: -0.45; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -2.36; (4)ACD/LogD (pH 7.4): -0.82; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 5.72; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 27.05 Å²; (13)Index of Refraction: 1.541; (14)Molar Refractivity: 35.32 cm³; (15)Molar Volume: 112.2 cm³; (16)Surface Tension: 40.5 dyne/cm; (17)Density: 1.12 g/cm³; (18)Flash Point: 134.3 °C; (19)Enthalpy of Vaporization: 56.86 kJ/mol; (20)Boiling Point: 298.5 °C at 760 mmHg; (21)Vapour Pressure: 0.000566 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: OCCn1ccnc1C
(2) InChI: InChI=1/C6H10N2O/c1-6-7-2-3-8(6)4-5-9/h2-3,9H,4-5H2,1H3
(3) InChIKey: JJWKKSUCSNDHNJ-UHFFFAOYAK