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290835-84-6

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Basic Information
CAS No.: 290835-84-6
Name: 2,4-DICHLORO-5-FLUORO-3-HYDROXYBENZOIC ACID
Molecular Structure:
Molecular Structure of 290835-84-6 (2,4-DICHLORO-5-FLUORO-3-HYDROXYBENZOIC ACID)
Formula: C7H3Cl2FO3
Molecular Weight: 225
Synonyms: 2,4-dichloro-5-fluoro-3-hydroxy-benzoic acid;2,4-Dichloro-5-fluoro-3-hydroxybenzoic acid;benzoic acid, 2,4-dichloro-5-fluoro-3-hydroxy-;
Density: 1.75 g/cm3
Boiling Point: 343.1 °C at 760 mmHg
Flash Point: 161.3 °C
PSA: 57.53000
LogP: 2.53630
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Specification

The Benzoic acid,2,4-dichloro-5-fluoro-3-hydroxy-, with the CAS registry number 290835-84-6, has the systematic name of 2,4-dichloro-5-fluoro-3-hydroxy-benzoic acid. It is a kind of organics, and should be stored in the dry and cool environment. And the molecular formula of the chemical is C7H3Cl2FO3.

The characteristics of Benzoic acid,2,4-dichloro-5-fluoro-3-hydroxy- are as followings: (1)ACD/LogP: 3.06; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.02 ; (4)#H bond acceptors: 3; (5)#H bond donors: 2; (6)#Freely Rotating Bonds: 2; (7)Polar Surface Area: 57.53 Å2; (8)Index of Refraction: 1.615; (9)Molar Refractivity: 44.84 cm3; (10)Molar Volume: 128.5 cm3; (11)Polarizability: 17.77×10-24cm3; (12)Surface Tension: 63.8 dyne/cm; (13)Density: 1.75 g/cm3; (14)Flash Point: 161.3 °C; (15)Enthalpy of Vaporization: 61.94 kJ/mol; (16)Boiling Point: 343.1 °C at 760 mmHg; (17)Vapour Pressure: 2.77E-05 mmHg at 25°C. 

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: Clc1c(cc(F)c(Cl)c1O)C(O)=O
(2)InChI: InChI=1/C7H3Cl2FO3/c8-4-2(7(12)13)1-3(10)5(9)6(4)11/h1,11H,(H,12,13)
(3)InChIKey: OEVPXZDUHKJUSX-UHFFFAOYAT