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CAS No.: | 694-32-6 |
---|---|
Name: | 1-METHYL-2-IMIDAZOLIDINONE |
Article Data: | 6 |
Molecular Structure: | |
Formula: | C4H8N2O |
Molecular Weight: | 100.12 |
Synonyms: | 1-Methyl-2-imidazolidinone;1-Methyl-2-imidazolidone;3-Methylimidazolidin-2-one;N-Methyl-1,3-propanediamine cyclic urea; |
Density: | 1.084 g/cm3 |
Melting Point: | 122-123℃ (benzene ) |
Boiling Point: | 289.8 °C at 760 mmHg |
Flash Point: | 129.1 °C |
Appearance: | off-white to beige crystalline solid |
Hazard Symbols: | Xn |
Risk Codes: | 36/38-21/22 |
Safety: | 36/37/39-26 |
PSA: | 32.34000 |
LogP: | -0.09190 |
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The 2-Imidazolidinone,1-methyl- is an organic compound with the formula C4H8N2O. The IUPAC name of this chemical is 1-methylimidazolidin-2-one. With the CAS registry number 694-32-6, it is also named as 2-imidazolidinone, 1-methyl-. The product's categories are Imidazoles; Pyrroles; Pyrazoles; Pyrrolidines. Besides, it should be stored in a closed and dry place.
Physical properties about 2-Imidazolidinone,1-methyl- are: (1)ACD/LogP: -0.42; (2)ACD/LogD (pH 5.5): -0.42; (3)ACD/LogD (pH 7.4): -0.42; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 14.11; (7)ACD/KOC (pH 7.4): 14.11; (8)#H bond acceptors: 3; (9)#H bond donors: 1; (10)Polar Surface Area: 23.55 Å2; (11)Index of Refraction: 1.466; (12)Molar Refractivity: 25.58 cm3; (13)Molar Volume: 92.3 cm3; (14)Polarizability: 10.14×10-24cm3; (15)Surface Tension: 32.4 dyne/cm; (16)Density: 1.084 g/cm3; (17)Flash Point: 129.1 °C; (18)Enthalpy of Vaporization: 52.91 kJ/mol; (19)Boiling Point: 289.8 °C at 760 mmHg; (20)Vapour Pressure: 0.00215 mmHg at 25°C.
Preparation of 2-Imidazolidinone,1-methyl-: this chemical can be prepared by imidazolidin-2-one and iodomethane. This reaction will need reagent potassium tertiobutylate.
Uses of 2-Imidazolidinone,1-methyl-: it can be used to produce 1-methyl-3-chloro imidazolidone at ambient temperature. It will need reagent chlorine and solvent H2O with reaction time of 15 min. The yield is about 70%.
When you are using this chemical, please be cautious about it as the following:
It is harmful in contact with skin and if swallowed. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. Besides, this chemical is irritating to eyes and skin. When you are using it, wear suitable gloves and eye/face protection.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C1NCCN1C
(2)InChI: InChI=1/C4H8N2O/c1-6-3-2-5-4(6)7/h2-3H2,1H3,(H,5,7)
(3)InChIKey: JTPZTKBRUCILQD-UHFFFAOYAC
(4)Std. InChI: InChI=1S/C4H8N2O/c1-6-3-2-5-4(6)7/h2-3H2,1H3,(H,5,7)
(5)Std. InChIKey: JTPZTKBRUCILQD-UHFFFAOYSA-N