Identification Chemical Properties Safety Data Hazard Information Supplier Related Products

61643-23-0

Name Leflunomide 3-Isomer
CAS 61643-23-0
EINECS(EC#) 642-277-6
Molecular Formula C12H9F3N2O2
MDL Number MFCD05741084
Molecular Weight 270.21
MOL File 61643-23-0.mol

Chemical Properties

Melting point  106 - 110℃
Boiling point  285.0±40.0 °C(Predicted)
density  1.392±0.06 g/cm3(Predicted)
storage temp.  Refrigerator, under inert atmosphere
solubility  Chloroform (Slightly), Methanol (Slightly)
form  neat
pka 11.62±0.70(Predicted)
color  White to Off-White
BRN  1083122
Major Application pharmaceutical (small molecule)
InChI 1S/C12H9F3N2O2/c1-7-10(6-16-19-7)11(18)17-9-4-2-3-8(5-9)12(13,14)15/h2-6H,1H3,(H,17,18)
InChIKey KBFQQKBZIFSAMY-UHFFFAOYSA-N
SMILES O=C(C1=C(C)ON=C1)NC2=CC=CC(C(F)(F)F)=C2

Safety Data

Hazard Codes  Xn
Risk Statements 
WGK Germany  WGK 3
HS Code  2934990002
Storage Class 11 - Combustible Solids
Hazard Classifications Acute Tox. 4 Oral

Hazard Information

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