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Triclabendazole Structure

Triclabendazole

Chemical Properties

Melting point 175-176°C
Boiling point 240.6°C (rough estimate)
Density  1.3875 (rough estimate)
refractive index  1.6000 (estimate)
storage temp.  Sealed in dry,Room Temperature
solubility  Acetonitrile (Slightly, Sonicated), Methanol (Slightly)
form  Solid
pka 7.91±0.10(Predicted)
color  White to Beige
Merck  14,9652
BCS Class 4/3
Stability Stability
InChI InChI=1S/C14H9Cl3N2OS/c1-21-14-18-9-5-8(16)12(6-10(9)19-14)20-11-4-2-3-7(15)13(11)17/h2-6H,1H3,(H,18,19)
InChIKey NQPDXQQQCQDHHW-UHFFFAOYSA-N
SMILES C1(SC)NC2=CC(Cl)=C(OC3=CC=CC(Cl)=C3Cl)C=C2N=1
CAS DataBase Reference 68786-66-3(CAS DataBase Reference)
EWG's Food Scores 1
FDA UNII 4784C8E03O
ATC code P02BX04

Safety

Symbol(GHS) GHS hazard pictograms
Signal wordWarning
Hazard statements H315-H319-H335
Precautionary statements P261-P305+P351+P338
Hazard Codes  Xi
Risk Statements  36/37/38
Safety Statements  26-36-24/25
WGK Germany  3
RTECS  DD6747000
HS Code  29339900
Toxicity LD50 oral in rabbit: 206mg/kg
NFPA 704:
1
2 0

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