PLECONARIL Structure

PLECONARIL

Chemical Properties

Melting point 61-62°
Boiling point 481.2±55.0 °C(Predicted)
Density  1.271
storage temp.  room temp
solubility  DMSO: ≥10mg/mL (warmed)
form  powder
pka -1.33±0.10(Predicted)
color  white to beige
InChI 1S/C18H18F3N3O3/c1-10-7-13(16-22-17(27-24-16)18(19,20)21)8-11(2)15(10)25-6-4-5-14-9-12(3)23-26-14/h7-9H,4-6H2,1-3H3
InChIKey KQOXLKOJHVFTRN-UHFFFAOYSA-N
SMILES Cc1cc(CCCOc2c(C)cc(cc2C)-c3noc(n3)C(F)(F)F)on1
FDA UNII 9H4570Q89D
NCI Drug Dictionary rimiducid
ATC code J05AX06
UNSPSC Code 12352200
NACRES NA.77

Safety

Symbol(GHS) Skull and Crossbones (GHS06)
Signal wordDanger
Hazard statements H301-H413
Precautionary statements P273-P301+P310+P330
Hazard Codes  T
Risk Statements  25
Safety Statements  45
RIDADR  UN 2811 6.1 / PGIII
WGK Germany  3
Storage Class 6.1C - Combustible acute toxic Cat.3
toxic compounds or compounds which causing chronic effects
Hazard Classifications Acute Tox. 3 Oral
Aquatic Chronic 4
NFPA 704:
0
2 0

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