72901-16-7

Name Bisacodyl Related Compound C (20 mg) (4-[(4-Hydroxyphenyl)(pyridin-2-yl)methyl]phenyl acetate)
CAS 72901-16-7
Molecular Formula C20H17NO3
MDL Number MFCD27966914
Molecular Weight 319.36
MOL File 72901-16-7.mol
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Chemical Properties

Boiling point  476.1±45.0 °C(Predicted)
density  1.219±0.06 g/cm3(Predicted)
storage temp.  2-8°C
solubility  Chloroform (Slightly), Ethyl Acetate (Slightly), Methanol (Slightly)
form  Solid
pka 10.00±0.10(Predicted)
color  White to Pale Yellow
Major Application pharmaceutical (small molecule)
InChI 1S/C20H17NO3/c1-14(22)24-18-11-7-16(8-12-18)20(19-4-2-3-13-21-19)15-5-9-17(23)10-6-15/h2-13,20,23H,1H3
InChIKey IGNJZSFTZVUILA-UHFFFAOYSA-N
SMILES n1c(cccc1)C(c3ccc(cc3)OC(=O)C)c2ccc(cc2)O

Safety Data

WGK Germany  WGK 3
HS Code  2933399090
Storage Class 11 - Combustible Solids

Hazard Information

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