Benzeneacetic acid,3-methoxy-, methyl ester (18927-05-4)

This chemical is called Methyl 2-(3-methoxyphenyl)acetate, and it can also be named as Benzeneacetic acid,3-methoxy-, methyl ester. With the CAS number of 18927-05-4, its IUPAC name is Methyl 2-(3-methoxyphenyl)acetate. In addition, the molecular formula of Methyl 2-(3-methoxyphenyl)acetate is C₁₀H₁₂O₃, and its molecular weight is 180.20. Besides, its product category is Aromatic Esters. 
 
Other characteristics of this chemical can be summarised as followings: (1)ACD/LogP: 1.88; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.88; (4)ACD/LogD (pH 7.4): 1.88; (5)ACD/BCF (pH 5.5): 15.84; (6)ACD/BCF (pH 7.4): 15.84; (7)ACD/KOC (pH 5.5): 251.44; (8)ACD/KOC (pH 7.4): 251.44; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 35.53 Å²; (13)Index of Refraction: 1.499; (14)Molar Refractivity: 48.88 cm³; (15)Molar Volume: 166.2 cm³; (16)Polarizability: 19.38×10^-24cm³; (17)Surface Tension: 35.2 dyne/cm; (18)Density: 1.083 g/cm³; (19)Flash Point: 100.2 °C; (20)Enthalpy of Vaporization: 49.15 kJ/mol; (21)Boiling Point: 254 °C at 760 mmHg; (22)Vapour Pressure: 0.0176 mmHg at 25°C.

Preparation of the Methyl 2-(3-methoxyphenyl)acetate: Using the reactants of methanol and the (3-methoxy-phenyl)-acetic acid, and the reagent of 10 percent HCl, you can get the product of  Methyl 2-(3-methoxyphenyl)acetate. Besides, this reaction needs 5 hour(s).



Uses of the Methyl 2-(3-methoxyphenyl)acetate: The product of diazo-(3-methoxy-phenyl)-acetic acid methyl ester would be made by the reactant of methyl (3-methoxyphenyl)acetate, the reagents of TsN₃, DBU and the solvent of acetonitrile. Besides, the temperature of this reaction should be kept 20  °C.



You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OC)Cc1cc(OC)ccc1
(2)InChI: InChI=1/C10H12O3/c1-12-9-5-3-4-8(6-9)7-10(11)13-2/h3-6H,7H2,1-2H3
(3)InChIKey: BSVIOYCZTJRBDB-UHFFFAOYAU
(4)Std. InChI: InChI=1S/C10H12O3/c1-12-9-5-3-4-8(6-9)7-10(11)13-2/h3-6H,7H2,1-2H3
(5)Std. InChIKey: BSVIOYCZTJRBDB-UHFFFAOYSA-N