The 3-Pentanone, 1-(4-chlorophenyl)-4,4-dimethyl-, with the CAS registry number 66346-01-8, is also known as 1-(4-Chlorophenyl)-4,4-dimethyl-3-pentanone. It belongs to the product category of Intermediate of tebuconazole. This chemical's molecular formula is C₁₃H₁₇ClO and molecular weight is 224.73. What's more, its systematic name is 1-(4-chlorophenyl)-4,4-dimethylpentan-3-one. Its classification code is TSCA Flag P [A commenced PMN (Premanufacture Notice) substance].

Physical properties of 3-Pentanone, 1-(4-chlorophenyl)-4,4-dimethyl- are: (1)ACD/LogP: 3.49; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.49; (4)ACD/BCF (pH 5.5): 266.54; (5)ACD/KOC (pH 5.5): 1896.56; (6)#H bond acceptors: 1; (7)#H bond donors: 0; (8)#Freely Rotating Bonds: 4; (9)Polar Surface Area: 17.07 Å²; (10)Index of Refraction: 1.508; (11)Molar Refractivity: 63.85 cm³; (12)Molar Volume: 213.9 cm³; (13)Polarizability: 25.31×10^-24cm³; (14)Surface Tension: 34.6 dyne/cm; (15)Density: 1.05 g/cm³; (16)Flash Point: 178.9 °C; (17)Enthalpy of Vaporization: 53.72 kJ/mol; (18)Boiling Point: 297.4 °C at 760 mmHg; (19)Vapour Pressure: 0.00136 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Clc1ccc(cc1)CCC(=O)C(C)(C)C
(2)InChI: InChI=1S/C13H17ClO/c1-13(2,3)12(15)9-6-10-4-7-11(14)8-5-10/h4-5,7-8H,6,9H2,1-3H3
(3)InChIKey: ILQGIJDYSLHIOX-UHFFFAOYSA-N

The toxicity data is as follows: