Basic Information | Post buying leads | Suppliers |
Name |
2-Chloro-4-hydroxyphenylboronic acid |
EINECS | N/A |
CAS No. | 766549-26-2 | Density | 1.49 g/cm3 |
PSA | 60.69000 | LogP | -0.27460 |
Solubility | N/A | Melting Point |
N/A |
Formula | C6H6BClO3 | Boiling Point | 380.7 °C at 760 mmHg |
Molecular Weight | 172.37 | Flash Point | 184 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
2-CHLORO-4-HYDROXYPHENYLBORONIC ACID |
The 2-Chloro-4-hydroxyphenylboronic acid is an organic compound with the formula C6H6BClO3. The systematic name of this chemical is (2-chloro-4-hydroxy-phenyl)boronic acid. With the CAS registry number 766549-26-2, it is also named as boronic acid, B-(2-chloro-4-hydroxyphenyl)-.
Physical properties about 2-Chloro-4-hydroxyphenylboronic acid are: (1)ACD/LogP: 1.77; (2)ACD/LogD (pH 5.5): 1.77; (3)ACD/LogD (pH 7.4): 1.72; (4)#H bond acceptors: 3; (5)#H bond donors: 3; (6)#Freely Rotating Bonds: 4; (7)Polar Surface Area: 60.69 Å2; (8)Index of Refraction: 1.602; (9)Molar Refractivity: 39.64 cm3; (10)Molar Volume: 115.5 cm3; (11)Polarizability: 15.71×10-24cm3; (12)Surface Tension: 61.9 dyne/cm; (13)Density: 1.49 g/cm3; (14)Flash Point: 184 °C; (15)Enthalpy of Vaporization: 66.34 kJ/mol; (16)Boiling Point: 380.7 °C at 760 mmHg; (17)Vapour Pressure: 1.79E-06 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: B(c1ccc(cc1Cl)O)(O)O
(2)InChI: InChI=1/C6H6BClO3/c8-6-3-4(9)1-2-5(6)7(10)11/h1-3,9-11H
(3)InChIKey: NRBQMBXPVAUMJY-UHFFFAOYAX
(4)Std. InChI: InChI=1S/C6H6BClO3/c8-6-3-4(9)1-2-5(6)7(10)11/h1-3,9-11H
(5)Std. InChIKey: NRBQMBXPVAUMJY-UHFFFAOYSA-N