3-(2,4-DICHLOROPHENYL)PROPIONIC ACID

This chemical is called  3-(2,4-Dichlorophenyl)propionic acid, and it can also be named as 2,4-Dichlorohydrocinnamic acid. With the molecular formula of C₉H₈Cl₂O₂, its molecular weight is 219.06. The CAS registry number of this chemical is 55144-92-8.

Other characteristics of the 3-(2,4-Dichlorophenyl)propionic acid can be summarised as followings: (1)ACD/LogP: 3.04; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.05; (4)ACD/LogD (pH 7.4): 0.24; (5)ACD/BCF (pH 5.5): 12.26; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 109.31; (8)ACD/KOC (pH 7.4): 1.72; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 26.3 Å²; (13)Index of Refraction: 1.572; (14)Molar Refractivity: 51.78 cm³; (15)Molar Volume: 157.2 cm³; (16)Polarizability: 20.53×10^-24cm³; (17)Surface Tension: 49.4 dyne/cm; (18)Density: 1.392 g/cm³; (19)Flash Point: 157.4 °C; (20)Enthalpy of Vaporization: 61.2 kJ/mol; (21)Boiling Point: 336.6 °C at 760 mmHg; (22)Vapour Pressure: 4.33E-05 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following: The 3-(2,4-Dichlorophenyl)propionic acid is harmful if swallowed. And it's irritating to respiratory system and skin, you should wear suitable protective clothing when you use it. In addition, this chemical is very toxic to aquatic organisms, and it may cause long-term adverse effects in the aquatic environment, so you should refer to special instructions / safety data sheets and avoid releasing it to the environment. In case of contacting with eyes, rinse immediately with plenty of water and seek medical advice. This material and its container must be disposed of as hazardous waste.

You can still convert the following datas into molecular structure: 
(1)SMILES: Clc1cc(Cl)ccc1CCC(=O)O
(2)InChI: InChI=1/C9H8Cl2O2/c10-7-3-1-6(8(11)5-7)2-4-9(12)13/h1,3,5H,2,4H2,(H,12,13)
(3)InChIKey: HLNPVFSCAMKIOD-UHFFFAOYAW
(4)Std. InChI: InChI=1S/C9H8Cl2O2/c10-7-3-1-6(8(11)5-7)2-4-9(12)13/h1,3,5H,2,4H2,(H,12,13)
(5)Std. InChIKey: HLNPVFSCAMKIOD-UHFFFAOYSA-N