CAS No.61224-27-9,1-(2,2-Diethoxyethyl)-3-methylurea Suppliers

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Basic Information

Molecular Structure:
CAS No.:	61224-27-9
Name:	1-(2,2-Diethoxyethyl)-3-methylurea
Article Data:	2

Formula:	C₈H₁₈N₂O₃
Molecular Weight:	190.2401
Synonyms:	N-(2,2-Diethoxyethyl)-N'-methyl-Urea;
Density:	1.01 g/cm³
Boiling Point:	332.441 °C at 760 mmHg
Flash Point:	154.855 °C
PSA:	59.59000
LogP:	1.09630

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Specification

The Urea,N-(2,2-diethoxyethyl)-N'-methyl-, with the CAS registry number of 61224-27-9, is also known as N-(2,2-Diethoxyethyl)-N'-methyl-Urea. Its molecular formula is C₈H₁₈N₂O₃ and molecular weight is 190.2401. What's more, its systematic name is 1-(2,2-Diethoxyethyl)-3-methylurea.

Physical properties about the Urea,N-(2,2-diethoxyethyl)-N'-methyl- are: (1)ACD/LogP: 0.18; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1; (4)ACD/LogD (pH 7.4): 1; (5)ACD/BCF (pH 5.5): 2; (6)ACD/BCF (pH 7.4): 2; (7)ACD/KOC (pH 5.5): 47; (8)ACD/KOC (pH 7.4): 47; (9)#H bond acceptors: 5; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 6; (12)Polar Surface Area: 59.59 Å²; (13)Index of Refraction: 1.441; (14)Molar Refractivity: 49.78 cm³; (15)Molar Volume: 188.443 cm³; (16)Surface Tension: 31.982 dyne/cm; (17)Density: 1.01 g/cm³; (18)Flash Point: 154.855 °C; (19)Enthalpy of Vaporization: 57.521 kJ/mol; (20)Boiling Point: 332.441 °C at 760 mmHg; (21)Vapour Pressure: 0 mmHg at 25 °C.

Preparation: this chemical can be obtained by Isocyanatomethane and 2,2-Diethoxy-ethylamine. The reaction needs reagent Benzene. The yield is about 100 %.

The Urea,N-(2,2-diethoxyethyl)-N'-methyl- can be obtained by Isocyanatomethane and 2,2-Diethoxy-ethylamine

Uses: it is used to produce other chemicals. For example, it is used to produce 1-Methyl-1,3-dihydro-imidazol-2-one. This reaction needs reagent HCl. Meanwhile, it needs solvent Methanol. The reaction time is 2 days. The yield is about 95 %.

The Urea,N-(2,2-diethoxyethyl)-N'-methyl- is used to produce 1-Methyl-1,3-dihydro-imidazol-2-one

You can still convert the following datas into molecular structure:
(1) SMILES: O=C(NCC(OCC)OCC)NC
(2) InChI: InChI=1/C8H18N2O3/c1-4-12-7(13-5-2)6-10-8(11)9-3/h7H,4-6H2,1-3H3,(H2,9,10,11)
(3) InChIKey: LYSNINURKGPALG-UHFFFAOYAF