3-(4-Chlorophenyl)glutaric acid

The CAS register number of 3-(4-Chlorophenyl)glutaric acid is 35271-74-0. It also can be called as Pentanedioic acid,3-(4-chlorophenyl)- and the IUPAC name about this chemical is 3-(4-chlorophenyl)pentanedioic acid. The molecular formula about this chemical is C₁₁H₁₁ClO₄ and the molecular weight is 242.66. It belongs to the following product categories, such as Miscellaneous Biochemicals; (intermediate of baclofen); Aromatics and so on. This chemical is no decompose under normal circumstances and no danger reaction. It can be stored in a seal, cool and dry place.

Physical properties about 3-(4-Chlorophenyl)glutaric acid are: (1)ACD/LogP: 1.16; (2)ACD/LogD (pH 5.5): -1.06; (3)ACD/LogD (pH 7.4): -3.55; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 4; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 5; (11)Polar Surface Area: 52.6Ų; (12)Index of Refraction: 1.578; (13)Molar Refractivity: 57.72 cm³; (14)Molar Volume: 173.7 cm³; (15)Polarizability: 22.88x10^-24cm³; (16)Surface Tension: 58.9 dyne/cm; (17)Enthalpy of Vaporization: 67.96 kJ/mol; (18)Boiling Point: 394.4 °C at 760 mmHg; (19)Vapour Pressure: 6.29E-07 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. 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: Clc1ccc(cc1)C(CC(=O)O)CC(=O)O
(2)InChI: InChI=1/C11H11ClO4/c12-9-3-1-7(2-4-9)8(5-10(13)14)6-11(15)16/h1-4,8H,5-6H2,(H,13,14)(H,15,16)
(3)InChIKey: URXVLIVRJJNJII-UHFFFAOYAB
(4)Std. InChI: InChI=1S/C11H11ClO4/c12-9-3-1-7(2-4-9)8(5-10(13)14)6-11(15)16/h1-4,8H,5-6H2,(H,13,14)(H,15,16)
(5)Std. InChIKey: URXVLIVRJJNJII-UHFFFAOYSA-N