N-[2-(3,4-Dimethoxyphenyl)-2-oxoethyl]-N-methylamine

The Ethanone,1-(3,4-dimethoxyphenyl)-2-(methylamino)-, with the CAS registry number 29705-77-9, is also known as 3',4'-Dimethoxy-2-(methylamino)acetophenone. It belongs to the product category of Benzene Series. This chemical's molecular formula is C₁₁H₁₅NO₃ and molecular weight is 209.2417. What's more, its IUPAC name and systematic name are the same which is called 1-(3,4-Dimethoxyphenyl)-2-(methylamino)ethanone. Additionally, it should be preserved hermetically and put in a cool, dry place.

Physical properties about Ethanone,1-(3,4-dimethoxyphenyl)-2-(methylamino)-: (1)ACD/LogP: 1.20; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 7.4): 0.76; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1.74; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 38.68; (8)#H bond acceptors: 4; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 5; (11)Polar Surface Area: 47.56 Å²; (12)Index of Refraction: 1.507; (13)Molar Refractivity: 57.86 cm³; (14)Molar Volume: 194.2 cm³; (15)Surface Tension: 35.2 dyne/cm; (16)Density: 1.076 g/cm³; (17)Flash Point: 154.7 °C; (18)Enthalpy of Vaporization: 57.5 kJ/mol; (19)Boiling Point: 332.2 °C at 760 mmHg; (20)Vapour Pressure: 0.000148 mmHg at 25 °C.

Uses of Ethanone,1-(3,4-dimethoxyphenyl)-2-(methylamino)-: it is used to produce other chemicals. For example, it can react with Furan-3-carbonyl chloride to get Furan-3-carboxylic acid [2-(3,4-dimethoxy-phenyl)-2-oxo-ethyl]-methyl-amide. The reaction occurs with reagents Et₃N and CH₂Cl₂ at temperature of -10°C for 1 hour. The yield is 94%.

You can still convert the following datas into molecular structure:
(1) SMILES: COc1cc(ccc1OC)C(=O)CNC
(2) InChI: InChI=1/C11H15NO3/c1-12-7-9(13)8-4-5-10(14-2)11(6-8)15-3/h4-6,12H,7H2,1-3H3
(3) InChIKey: CKCVYNURNIMPNJ-UHFFFAOYAW