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CAS No.: | 7600-50-2 |
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Name: | 2,5-Dichloro-3-hydroxy-6-methoxybenzoic acid |
Molecular Structure: | |
Formula: | C8H6Cl2O4 |
Molecular Weight: | 237.04 |
Synonyms: | o-Anisicacid, 3,6-dichloro-5-hydroxy- (8CI);3,6-Dichloro-5-hydroxy-o-anisic acid;5-Hydroxy-3,6-dichloro-o-anisic acid;5-Hydroxydicamba; |
Density: | 1.598 g/cm3 |
Boiling Point: | 383.6 °C at 760 mmHg |
Flash Point: | 185.8 °C |
PSA: | 29.46000 |
LogP: | 2.88520 |
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The 2,5-Dichloro-3-hydroxy-6-methoxybenzoic acid with its cas register number is 7600-50-2. It also can be called as 3,6-Dichloro-5-hydroxy-o-anisic acid and the IUPAC Name about this chemical is 2,5-dichloro-3-hydroxy-6-methoxybenzoic acid. It belongs to the following product categories, such as
Physical properties about 2,5-Dichloro-3-hydroxy-6-methoxybenzoic acid are: (1)ACD/LogP: 2.55; (2)ACD/LogD (pH 5.5): -0.36; (3)ACD/LogD (pH 7.4): -0.64; (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: 3; (11)Polar Surface Area: 44.76Å2; (12)Index of Refraction: 1.611; (13)Molar Refractivity: 51.53 cm3; (14)Molar Volume: 148.2 cm3; (15)Polarizability: 20.42x10-24cm3; (16)Surface Tension: 60 dyne/cm; (17)Enthalpy of Vaporization: 66.68 kJ/mol; (18)Vapour Pressure: 1.43E-06 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: COC1=C(C=C(C(=C1C(=O)O)Cl)O)Cl
(2)InChI: InChI=1S/C8H6Cl2O4/c1-14-7-3(9)2-4(11)6(10)5(7)8(12)13/h2,11H,1H3,(H,12,13)
(3)InChIKey: XYHBJALHMANCCC-UHFFFAOYSA-N