25459-12-5

Name TINIDAZOLE RELATED COMPOUND B (20 MG) (1-(2-ETHYL-SULFONYLETHYL)-2-METHYL-4-NITROIMIDAZOLE)
CAS 25459-12-5
Molecular Formula C8H13N3O4S
MDL Number MFCD01880401
Molecular Weight 247.27
MOL File 25459-12-5.mol
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Chemical Properties

Melting point  136-139 °C
Boiling point  528.4±30.0 °C(Predicted)
density  1.43±0.1 g/cm3(Predicted)
storage temp.  2-8°C
solubility  DMSO (Slightly)
pka 0.78±0.60(Predicted)
Major Application pharmaceutical (small molecule)
InChI 1S/C8H13N3O4S/c1-3-16(14,15)5-4-10-6-8(11(12)13)9-7(10)2/h6H,3-5H2,1-2H3
InChIKey GHJQUSZGINOURI-UHFFFAOYSA-N
SMILES [S](=O)(=O)(CC[n]1c(nc(c1)[N+](=O)[O-])C)CC

Safety Data

WGK Germany  WGK 3
HS Code  2933290000
Storage Class 11 - Combustible Solids

Hazard Information

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