2-CHLORO-2-ETHOXYACETIC ACID ETHYL ESTER

The CAS register number of Ethyl chloro(ethoxy)acetate is 34006-60-5. It also can be called as Acetic acid,2-chloro-2-ethoxy-, ethyl ester and the IUPAC name about this chemical is ethyl 2-(1-chloroethoxy)acetate. The molecular formula about this chemical is C₆H₁₁ClO₃ and molecular weight is 166.60.

Physical properties about Ethyl chloro(ethoxy)acetate are: (1)ACD/LogP: 1.67; (2)ACD/LogD (pH 5.5): 1.67; (3)ACD/LogD (pH 7.4): 1.67; (4)ACD/BCF (pH 5.5): 11.02; (5)ACD/BCF (pH 7.4): 11.02; (6)ACD/KOC (pH 5.5): 193.86; (7)ACD/KOC (pH 7.4): 193.86; (8)#H bond acceptors: 3; (9)#Freely Rotating Bonds: 5; (10)Polar Surface Area: 35.53Ų; (11)Index of Refraction: 1.425; (12)Molar Refractivity: 38.17 cm³; (13)Molar Volume: 149.1 cm³; (14)Polarizability: 15.13x10^-24cm³; (15)Surface Tension: 30.6 dyne/cm; (16)Enthalpy of Vaporization: 44.58 kJ/mol; (17)Boiling Point: 209.5 °C at 760 mmHg; (18)Vapour Pressure: 0.202 mmHg at 25°C.

Preparation: this chemical can be prepared by diethoxyacetic acid ethyl ester with reaction temperature of 80 - 140 ℃. This reaction will need reagent PCl₅ .

Uses of Ethyl chloro(ethoxy)acetate: it can be used to produce benzylhydrazone of ethyl glyoxylate with benzylhydrazine; dihydrochloride. This reaction will need solvent H₂O, dioxane with reaction time of 1 hours. The yield is about 76%.

When you are using this chemical, please be cautious about it as the following:
This chemical is irritating to eyes, respiratory system and skin. When you are using it, wear suitable gloves and eye/face protection. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OCC)C(Cl)OCC
(2)InChI: InChI=1/C6H11ClO3/c1-3-9-5(7)6(8)10-4-2/h5H,3-4H2,1-2H3
(3)InChIKey: CCAITLKAFIMPIT-UHFFFAOYAS
(4)Std. InChI: InChI=1S/C6H11ClO3/c1-3-9-5(7)6(8)10-4-2/h5H,3-4H2,1-2H3
(5)Std. InChIKey: CCAITLKAFIMPIT-UHFFFAOYSA-N