4394-00-7

Name Niflumic acid
CAS 4394-00-7
EINECS(EC#) 224-516-2
Molecular Formula C13H9F3N2O2
MDL Number MFCD00010569
Molecular Weight 282.22
MOL File 4394-00-7.mol

Chemical Properties

Appearance Crystalline Solid
Melting point  203-204 °C
Boiling point  378.0±42.0 °C(Predicted)
density  1.3935 (estimate)
storage temp.  Store at RT
solubility  Soluble in ethanol (~50 mg/ml), acetone (50 mg/ml, Clear to Slightly Hazy, Yellow), methanol (~50 mg/ml), DMSO (56 mg/ml at 25°C), and acetonitrile (~50 mg/ml).
form  neat
pka pKa 2.26 ± 0.08;4.44± 0.03(H2O,t =25±0.1,I=0.01(NaCl))(Approximate)
color  Light orange to Yellow to Green
Stability: Stable, but may discolour in light. Incompatible with strong oxidizing agents. Hygroscopic.
biological source synthetic (organic)
Water Solubility  19mg/L(room temperature)
Sensitive  Light Sensitive
Merck  14,6531
InChI 1S/C13H9F3N2O2/c14-13(15,16)8-3-1-4-9(7-8)18-11-10(12(19)20)5-2-6-17-11/h1-7H,(H,17,18)(H,19,20)
InChIKey JZFPYUNJRRFVQU-UHFFFAOYSA-N
SMILES O=C(O)C1=CC=CN=C1NC2=CC(C(F)(F)F)=CC=C2
NIST Chemistry Reference Niflumic acid(4394-00-7)
EPA Substance Registry System 3-Pyridinecarboxylic acid, 2-[[3-(trifluoromethyl)phenyl]amino]- (4394-00-7)

Safety Data

Hazard Codes  Xn
Risk Statements 
Safety Statements 
RIDADR  UN 2811 6.1/PG 3
WGK Germany  3
RTECS  QT2999100
REACH Registrations Active
HazardClass  6.1
PackingGroup  Ⅲ
HS Code  29333999
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
Toxicity
LD50 in rats (mg/kg): 370 orally; 155 i.p. (Sorenson)

Hazard Information

Material Safety Data Sheet(MSDS)

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