METHYL ACETIMIDATE HYDROCHLORIDE

This chemical is called Methyl acetimidate hydrochloride, and its systematic name is 1-methoxyethaniminium chloride. With the CAS registry number of 14777-27-6, its product categories are Amidates/Imidates; Nitrogen Compounds; Organic Building Blocks. Additionally, it should be stored at the temperature of 2-8°C.

Other characteristics of the Methyl acetimidate hydrochloride can be summarised as followings: (1)ACD/LogP: -0.33; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -2.24; (4)ACD/LogD (pH 7.4): -1.09; (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): 2.74; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 12.24 Å²; (13)Flash Point: 5.7 °C; (14)Enthalpy of Vaporization: 25.94 kJ/mol; (15)Boiling Point: 24.4 °C at 760 mmHg; (16)Vapour Pressure: 778 mmHg at 25°C.

Production method of this chemical: The Methyl acetimidate hydrochloride could be obtained by the reactants of acetonitrile and methanol. This reaction needs the reagent of HCl, and the yield is 91 %.

Uses of this chemical: The Methyl acetimidate hydrochloride could react with 2-amino-phenol, and obtain the 2-methyl-benzooxazole. This reaction needs the solvent of methanol. The yield is 38 %. In addition, this reaction should be taken for 30 minutes. The other condition is heating.

When you are using this chemical, please be cautious about it as the following: This chemical is irritating to eyes, respiratory system and skin. You should wear suitable protective clothing if you use it. In case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure: 
1.SMILES: [Cl-].O(/C(=[NH2+])C)C
2.InChI: InChI=1/C3H7NO.ClH/c1-3(4)5-2;/h4H,1-2H3;1H
3.InChIKey: WHYJXXISOUGFLJ-UHFFFAOYAI