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Benzoic acid, 2,4-difluoro-6-hydroxy-

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Name

Benzoic acid, 2,4-difluoro-6-hydroxy-

EINECS N/A
CAS No. 189283-54-3 Density 1.6 g/cm3
PSA 57.53000 LogP 1.36860
Solubility N/A Melting Point 180.8-183.4 °C
Formula C7H4F2O3 Boiling Point 290.6 °C at 760 mmHg
Molecular Weight 174.104 Flash Point 129.5 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 189283-54-3 (2,4-DIFLUORO-6-HYDROXY-BENZOIC ACID) Hazard Symbols N/A
Synonyms

2,4-Difluoro-6-hydroxybenzoicacid;

Article Data 3

Benzoic acid, 2,4-difluoro-6-hydroxy- Specification

The Benzoic acid, 2,4-difluoro-6-hydroxy-, with the CAS registry number 189283-54-3, is also known as 2,4-Difluoro-6-hydroxybenzoicacid. This chemical's molecular formula is C7H4F2O3 and molecular weight is 174.1017. What's more, its systematic name is called 2,4-Difluoro-6-hydroxybenzoic acid.

Physical properties about Benzoic acid, 2,4-difluoro-6-hydroxy- are: (1)ACD/LogP: 3.03; (2)#of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 1; (6)ACD/KOC (pH 7.4): 1; (7)#H bond acceptors: 3; (8)#H bond donors: 2; (9)#Freely Rotating Bonds: 2; (10)Polar Surface Area: 57.53 Å2; (11)Index of Refraction: 1.557; (12)Molar Refractivity: 35.05 cm3; (13)Molar Volume: 108.8 cm3; (14)Polarizability: 13.89×10-24 cm3; (15)Surface Tension: 56.7 dyne/cm; (16)Density: 1.6 g/cm3; (17)Flash Point: 129.5 °C; (18)Enthalpy of Vaporization: 55.97 kJ/mol; (19)Boiling Point: 290.6 °C at 760 mmHg; (20)Vapour Pressure: 0.000944 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O=C(O)c1c(F)cc(F)cc1O
(2) InChI: InChI=1/C7H4F2O3/c8-3-1-4(9)6(7(11)12)5(10)2-3/h1-2,10H,(H,11,12)
(3) InChIKey: DHJRFSOFNFQKJE-UHFFFAOYAQ

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