211914-51-1

Name Dabigatran
CAS 211914-51-1
Molecular Formula C25H25N7O3
MDL Number MFCD09837830
Molecular Weight 471.51
MOL File 211914-51-1.mol

Chemical Properties

Melting point  268-272°C
Boiling point  797.1±70.0 °C(Predicted)
density  1.38±0.1 g/cm3(Predicted)
storage temp.  Refrigerator, Under Inert Atmosphere
solubility  Aqueous Acid
form  Solid
pka 4.17±0.10(Predicted)
color  White to Brown
InChIKey YBSJFWOBGCMAKL-UHFFFAOYSA-N
SMILES C(O)(=O)CCN(C(C1=CC=C2N(C)C(CNC3=CC=C(C(N)=N)C=C3)=NC2=C1)=O)C1=NC=CC=C1

Safety Data

WGK Germany  WGK 3
Storage Class 11 - Combustible Solids
Hazardous Substances Data 211914-51-1(Hazardous Substances Data)

Hazard Information

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