168167-42-8

Name 4-Desmethoxypropoxyl-4-chloro Rabeprazole
CAS 168167-42-8
Molecular Formula C14H12ClN3OS
MDL Number MFCD09840357
Molecular Weight 305.78
MOL File 168167-42-8.mol
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Chemical Properties

Appearance Tan Solid
Melting point  128-130°C
Boiling point  564.1±60.0 °C(Predicted)
density  1.50±0.1 g/cm3(Predicted)
storage temp.  -20°C Freezer
solubility  DMSO (Slightly), Methanol (Slightly, Heated, Sonicated)
form  Solid
pka 9.56±0.10(Predicted)
color  Light Beige to Brown
Major Application pharmaceutical (small molecule)
InChI 1S/C14H12ClN3OS/c1-9-10(15)6-7-16-13(9)8-20(19)14-17-11-4-2-3-5-12(11)18-14/h2-7H,8H2,1H3,(H,17,18)
InChIKey RAPCQINSRSZSKF-UHFFFAOYSA-N
SMILES [S](=O)(Cc3nccc(c3C)Cl)c1[nH]c2c(n1)cccc2

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H302
Precautionary statements  P264-P270-P301+P312-P330-P501
WGK Germany  WGK 3
HS Code  2933997500
Storage Class 11 - Combustible Solids

Hazard Information

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