5-FLUORO-2-METHOXYBENZOIC ACID

The 5-Fluoro-2-methoxybenzoic acid is an organic compound with the formula C₈H₇FO₃. The systematic name of this chemical is 5-fluoro-2-methoxybenzoic acid. With the CAS registry number 394-04-7, it is also named as Benzoic acid, 5-fluoro-2-methoxy-. The product's categories are Aromatic Carboxylic Acids, Amides, Anilides, Anhydrides & Salts;Benzoic Acid; Acids & Esters; Anisoles, Alkyloxy Compounds & Phenylacetates; Fluorine Compounds; Aromatic Amino Acids; Peptide Synthesis; Unnatural Amino Acid Derivatives. Besides, it should be stored in closed cool and dry place.

Physical properties about 5-Fluoro-2-methoxybenzoic acid are: (1)ACD/LogP: 1.84; (2)ACD/LogD (pH 5.5): 0.1; (3)ACD/LogD (pH 7.4): -1.19; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 4.34; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 3; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 2; (11)Polar Surface Area: 35.53 Å²; (12)Index of Refraction: 1.524; (13)Molar Refractivity: 39.85 cm³; (14)Molar Volume: 130.1 cm³; (15)Polarizability: 15.79×10^-24cm³; (16)Surface Tension: 42.9 dyne/cm; (17)Density: 1.307 g/cm³; (18)Flash Point: 131.6 °C; (19)Enthalpy of Vaporization: 56.35 kJ/mol; (20)Boiling Point: 294 °C at 760 mmHg; (21)Vapour Pressure: 0.000757 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 gloves and eye/face protection. 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: Fc1ccc(OC)c(C(=O)O)c1
(2)InChI: InChI=1/C8H7FO3/c1-12-7-3-2-5(9)4-6(7)8(10)11/h2-4H,1H3,(H,10,11)
(3)InChIKey: WPXFJBPJUGMYOD-UHFFFAOYAB
(4)Std. InChI: InChI=1S/C8H7FO3/c1-12-7-3-2-5(9)4-6(7)8(10)11/h2-4H,1H3,(H,10,11)
(5)Std. InChIKey: WPXFJBPJUGMYOD-UHFFFAOYSA-N