(10-Phenylanthracen-9-yl)boronic acid CAS NO.334658-75-2

1.Introduction of 334658-75-2

With the systematic name of (10-Phenylanthracen-9-yl)boronic acid, it has the CAS number of 334658-75-2. It is a kind of yellow powder, with the purity of 98% provided by our company in the market. It is used as organic chemicals and derivatives/others, OLED, OLED materials, pharm chemical and electronic chemical.

2.Properties of 334658-75-2

ACD/LogP: 5.808
# of Rule of 5 Violations: 1
ACD/LogD (pH 5.5): 5.81
ACD/LogD (pH 7.4): 5.78
ACD/BCF (pH 5.5): 15267.98
ACD/BCF (pH 7.4): 14356.88
ACD/KOC (pH 5.5): 34374.68
ACD/KOC (pH 7.4): 32323.41
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 4
Polar Surface Area: 40.46  2
Index of Refraction: 1.727
Molar Refractivity: 93.109 cm3
Molar Volume: 233.978 cm3
Polarizability: 36.911 10-24cm3
Surface Tension: 60.8769989013672 dyne/cm
Density: 1.274 g/cm3
Flash Point: 269.088 °C
Enthalpy of Vaporization: 83.642 kJ/mol
Boiling Point: 521.325 °C at 760 mmHg
Vapour Pressure: 0 mmHg at 25°C

3.Structure Descriptors of 334658-75-2

(1)InChI: InChI=1S/C20H15BO2/c22-21(23)20-17-12-6-4-10-15(17)19(14-8-2-1-3-9-14)16-11-5-7-13-18(16)20/h1-13,22-23H
(2)InChIKey: RVPCPPWNSMAZKR-UHFFFAOYSA-N
(3)Canonical SMILES : B(C1=C2C=CC=CC2=C(C3=CC=CC=C13)C4=CC=CC=C4)(O)O

4.Disposal considerations

Observe all federal, state, and local environmental regulations. Contact a licensed professional waste disposal service to dispose of this material. Dissolve or mix the material with a combustible solvent and burn in a chemical incinerator equipped with an afterburner and scrubber.