Name: 3,5-DIFLUORO-2-HYDROXY-BENZOIC ACID
SKU: 84376-20-5

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Basic Information

Molecular Structure:
CAS No.:	84376-20-5
Name:	3,5-DIFLUORO-2-HYDROXY-BENZOIC ACID
Article Data:	5

Formula:	C₇H₄F₂O₃
Molecular Weight:	174.104
Synonyms:	3,5-Difluorosalicylic acid;Benzoic acid, 3,5-difluoro-2-hydroxy-;
Density:	1.6 g/cm³
Melting Point:	188-189℃ (toluene )
Boiling Point:	276.6 °C at 760 mmHg
Flash Point:	121.1 °C
Hazard Symbols:	Xi
PSA:	57.53000
LogP:	1.36860

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Specification

The 3,5-Difluoro-2-hydroxybenzoic acid is an organic compound with the formula C₇H₄F₂O₃. The IUPAC name of this chemical is 3,5-Difluoro-2-hydroxybenzoic acid. With the CAS registry number 84376-20-5, it is also named as 3,5-Difluorosalicylic acid. The category of the product is Pharmacetical. Besides, its molecular weight is 174.10.

The physical properties of 3,5-Difluoro-2-hydroxybenzoic acid are: (1)ACD/LogP: 3.05; (2)ACD/LogD (pH 5.5): -0.08; (3)ACD/LogD (pH 7.4): -0.1; (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: 3; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 2; (11)Polar Surface Area: 35.53 Å²; (12)Index of Refraction: 1.557; (13)Molar Refractivity: 35.05 cm³; (14)Molar Volume: 108.8 cm³; (15)Polarizability: 13.89×10^-24 cm³; (16)Surface Tension: 56.7 dyne/cm; (17)Density: 1.6 g/cm³; (18)Flash Point: 121.1 °C; (19)Enthalpy of Vaporization: 54.41 kJ/mol; (20)Boiling Point: 276.6 °C at 760 mmHg; (21)Vapour Pressure: 0.0023 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)SMILES: Fc1cc(C(=O)O)c(O)c(F)c1
(2)InChI: InChI=1/C7H4F2O3/c8-3-1-4(7(11)12)6(10)5(9)2-3/h1-2,10H,(H,11,12)
(3)InChIKey: GZPCNALAXFNOBT-UHFFFAOYAA
(4)Std. InChI: InChI=1S/C7H4F2O3/c8-3-1-4(7(11)12)6(10)5(9)2-3/h1-2,10H,(H,11,12)
(5)Std. InChIKey: GZPCNALAXFNOBT-UHFFFAOYSA-N