p,p'-(2-pyridylmethylene)bisphenol Chemical Properties

Melting point:

>200°C (dec.)

Boiling point:

462.1±40.0 °C(Predicted)

Density 

1.244±0.06 g/cm3(Predicted)

storage temp. 

Refrigerator, Under Inert Atmosphere

solubility 

DMF: 30 mg/ml; DMSO: 30 mg/ml; DMSO:PBS (pH 7.2)(1:8): 0.11 mg/ml; Ethanol: 2.5 mg/ml

form 

A crystalline solid

pka

9.71±0.10(Predicted)

color 

White to off-white

Major Application

pharmaceutical (small molecule)

InChI

InChI=1S/C18H15NO2/c20-15-8-4-13(5-9-15)18(17-3-1-2-12-19-17)14-6-10-16(21)11-7-14/h1-12,18,20-21H

InChIKey

LJROKJGQSPMTKB-UHFFFAOYSA-N

SMILES

C(C1=CC=C(O)C=C1)(C1=CC=C(O)C=C1)C1=NC=CC=C1

LogP

2.31 at 22℃ and pH7

Safety Information

WGK Germany 

WGK 2

HS Code 

2933399090

Storage Class

11 - Combustible Solids

p,p'-(2-pyridylmethylene)bisphenol Usage And Synthesis

Chemical Properties

White Solid

Uses

The active form of Bisacodyl. Cathartic.