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171596-28-4

Name cis-ent-Tadalafil
CAS 171596-28-4
Molecular Formula C22H19N3O4
MDL Number MFCD21363860
Molecular Weight 389.4
MOL File 171596-28-4.mol

Chemical Properties

Melting point  287-289 °C(Solv: toluene (108-88-3))
Boiling point  679.1±55.0 °C(Predicted)
density  1.51±0.1 g/cm3(Predicted)
storage temp.  Refrigerator
solubility  Chloroform (Slightly), DMSO (Slightly)
form  Solid
pka 16.68±0.40(Predicted)
color  White to Off-White
InChI InChI=1S/C22H19N3O4/c1-24-10-19(26)25-16(22(24)27)9-14-13-4-2-3-5-15(13)23-20(14)21(25)12-6-7-17-18(8-12)29-11-28-17/h2-8,16,21,23H,9-11H2,1H3/t16-,21+/m1/s1
InChIKey WOXKDUGGOYFFRN-IERDGZPVSA-N
SMILES N1C2=C(C=CC=C2)C2C[C@]3([H])C(=O)N(C)CC(=O)N3[C@@H](C3=CC=C4OCOC4=C3)C1=2

Safety Data

Symbol(GHS) 
GHS07
Signal word  Warning
Hazard statements  H315-H319-H335
Precautionary statements  P261-P264-P271-P280-P302+P352-P304+P340+P312-P305+P351+P338-P332+P313-P337+P313-P403+P233-P405-P501

Hazard Information

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