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Pretomanid Structure

Pretomanid

Chemical Properties

Melting point 149-150℃
Boiling point 462.3±55.0 °C(Predicted)
Density  1.58
storage temp.  -20°C
solubility  DMSO (Slightly), Methanol (Slightly)
pka -0.67±0.40(Predicted)
form  powder
color  white to brown
optical activity [α]/D -40 to -48°, c = 1 in methanol
InChI InChI=1S/C14H12F3N3O5/c15-14(16,17)25-10-3-1-9(2-4-10)7-23-11-5-19-6-12(20(21)22)18-13(19)24-8-11/h1-4,6,11H,5,7-8H2/t11-/m0/s1
InChIKey ZLHZLMOSPGACSZ-NSHDSACASA-N
SMILES O1C[C@@H](OCC2=CC=C(OC(F)(F)F)C=C2)CN2C=C([N+]([O-])=O)N=C12

Safety Information

WGK Germany  WGK 3
HS Code  2933992000
Storage Class 11 - Combustible Solids
Hazard Classifications Eye Irrit. 2
Skin Irrit. 2
STOT SE 3

Usage And Synthesis

Pretomanid Supplier

Pretomanid manufacturers