3-Carboxy-4-fluorophenylboronic acid

The CAS register number of 4-Carboxy-3-fluorophenylboronic acid is 120153-08-4. It also can be called as 3-Carboxy-4-fluorophenylboronic acid and the IUPAC name about this chemical is 4-borono-2-fluorobenzoic acid. The molecular formula about this chemical is C₇H₆BFO₄ and the molecular weight is 183.93. It belongs to the following product categories, such as Blocks; BoronicAcids; Carboxes; FluoroCompounds; Heterocyclic Compounds; Boronic Acid; Aryl; Organoborons and so on.

Physical properties about 4-Carboxy-3-fluorophenylboronic acid are: (1)ACD/LogP: 1.23; (2)ACD/LogD (pH 5.5): -1.3; (3)ACD/LogD (pH 7.4): -2.42; (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: 3; (10)#Freely Rotating Bonds: 4; (11)Polar Surface Area: 44.76Ų; (12)Index of Refraction: 1.559; (13)Molar Refractivity: 39.67 cm³; (14)Molar Volume: 122.7 cm³; (15)Polarizability: 15.72x10^-24cm³; (16)Surface Tension: 58.5 dyne/cm; (17)Enthalpy of Vaporization: 68.57 kJ/mol; (18)Boiling Point: 399.5 °C at 760 mmHg; (19)Vapour Pressure: 4.23E-07 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 protective clothing, 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: O=C(O)c1ccc(cc1F)B(O)O
(2)InChI: InChI=1/C7H6BFO4/c9-6-3-4(8(12)13)1-2-5(6)7(10)11/h1-3,12-13H,(H,10,11)
(3)InChIKey: CZDWJVSOQOMYGC-UHFFFAOYAT
(4)Std. InChI: InChI=1S/C7H6BFO4/c9-6-3-4(8(12)13)1-2-5(6)7(10)11/h1-3,12-13H,(H,10,11)
(5)Std. InChIKey: CZDWJVSOQOMYGC-UHFFFAOYSA-N