Ethyl 4-chloro-2-(trifluoromethyl)pyrimidine-5-carboxylate

The CAS register number of Ethyl 4-chloro-2-(trifluoromethyl)pyrimidine-5-carboxylate is 720-01-4. It also can be called as 5-Pyrimidinecarboxylic acid, 4-chloro-2-(trifluoromethyl)-, ethyl ester and the IUPAC name about this chemical is ethyl 4-chloro-2-(trifluoromethyl)pyrimidine-5-carboxylate. The molecular formula about this chemical is C₈H₆ClF₃N₂O₂ and the molecular weight is 254.59. It belongs to the following product categories, such as Esters; Pyrazines, Pyrimidines & Pyridazines; Pyrazines, Pyrimidines & Pyridazines and so on.

Physical properties about Ethyl 4-chloro-2-(trifluoromethyl)pyrimidine-5-carboxylate are: (1)ACD/LogP: 2.23; (2)ACD/LogD (pH 5.5): 2.227; (3)ACD/LogD (pH 7.4): 2.227; (4)ACD/BCF (pH 5.5): 29.032; (5)ACD/BCF (pH 7.4): 29.032; (6)ACD/KOC (pH 5.5): 387.92; (7)ACD/KOC (pH 7.4): 387.92; (8)#H bond acceptors: 4; (9)#Freely Rotating Bonds: 3; (10)Polar Surface Area: 52.08Ų; (11)Index of Refraction: 1.466; (12)Molar Refractivity: 48.716 cm³; (13)Molar Volume: 175.742 cm³; (14)Polarizability: 19.313x10^-24cm³; (15)Surface Tension: 36.946 dyne/cm; (16)Enthalpy of Vaporization: 46.729 kJ/mol; (17)Boiling Point: 230.647 °C at 760 mmHg; (18)Vapour Pressure: 0.065 mmHg at 25°C.

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 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: CCOC(=O)c1cnc(nc1Cl)C(F)(F)F
(2)InChI: InChI=1/C8H6ClF3N2O2/c1-2-16-6(15)4-3-13-7(8(10,11)12)14-5(4)9/h3H,2H2,1H3
(3)InChIKey: DSULCDCBENGHAX-UHFFFAOYAM
(4)Std. InChI: InChI=1S/C8H6ClF3N2O2/c1-2-16-6(15)4-3-13-7(8(10,11)12)14-5(4)9/h3H,2H2,1H3
(5)Std. InChIKey: DSULCDCBENGHAX-UHFFFAOYSA-N