Butanoicacid, 2-chloro-4,4,4-trifluoro-3-oxo-, ethyl ester (363-58-6)

The Ethyl 2-chloro-4,4,4-trifluoroacetoacetate with cas registry number of 363-58-6, is also named Acetoaceticacid, 2-chloro-4,4,4-trifluoro-, ethyl ester (6CI,7CI,8CI) ; 2-Chloro-4,4,4-trifluoro-3-oxobutanoic acid ethyl ester ; Ethyl2-chloro-3-oxo-4,4,4-trifluorobutanoate ; Ethyl2-chloro-3-oxo-4,4,4-trifluorobutyrate ; Ethyl2-chloro-4,4,4-trifluoro-3-oxobutanoate ; Ethyl2-chloro-4,4,4-trifluoroacetoacetate ; Ethyl4,4,4-trifluoro-2-chloro-3-oxobutanoate ; ART-CHEM-BB B023057 ; AKOS B023057 ; Ethyl 2-chloro-4,4,4-trifluoroacetoacetate 95% .

Physical properties of Ethyl 2-chloro-4,4,4-trifluoroacetoacetate : (1)ACD/LogP:  3.92; (2)# of Rule of 5 Violations:  0; (3)ACD/LogD (pH 5.5):  3.27; (4)ACD/LogD (pH 7.4):  1.75; (5)ACD/BCF (pH 5.5):  125.72; (6)ACD/BCF (pH 7.4):  3.76; (7)ACD/KOC (pH 5.5):  725.43; (8)ACD/KOC (pH 7.4):  21.72; (9)#H bond acceptors:  3; (10)#H bond donors:  0; (11)#Freely Rotating Bonds:  4; (12)Polar Surface Area:  43.37 Å²; (13)Index of Refraction:  1.388; (14)Molar Refractivity:  36.91 cm³; (15)Molar Volume:  156.3 cm³; (16)Polarizability:  14.63×10^-24cm³; (17)Surface Tension:  28.1 dyne/cm; (18)Enthalpy of Vaporization:  41.11 kJ/mol; (19)Vapour Pressure:  1.19 mmHg at 25°C .

When you are using this chemical, please be cautious about it as the following:
Firstly, Ethyl 2-chloro-4,4,4-trifluoroacetoacetate is irritating not only to eyes, respiratory system but also is irritating to skin. When using it, please wear suitable protective clothing, 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(C(Cl)C(=O)OCC)C(F)(F)F; (2)InChI:InChI=1/C6H6ClF3O3/c1-2-13-5(12)3(7)4(11)6(8,9)10/h3H,2H2,1H3; (3)InChIKey:YVWUNJVPOCYLIM-UHFFFAOYAD; (4)Std. InChI:InChI=1S/C6H6ClF3O3/c1-2-13-5(12)3(7)4(11)6(8,9)10/h3H,2H2,1H3; (5)Std. InChIKey:YVWUNJVPOCYLIM-UHFFFAOYSA-N .