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Mefenacet Structure

Mefenacet

Chemical Properties

Melting point 134.8°
Boiling point 441.0±47.0 °C(Predicted)
Density  1.2361 (rough estimate)
refractive index  1.6000 (estimate)
Flash point >100 °C
storage temp.  0-6°C
solubility  DMSO (Slightly), Methanol (Slightly)
pka 1.53±0.10(Predicted)
BRN  1143987
InChI InChI=1S/C16H14N2O2S/c1-18(12-7-3-2-4-8-12)15(19)11-20-16-17-13-9-5-6-10-14(13)21-16/h2-10H,11H2,1H3
InChIKey XIGAUIHYSDTJHW-UHFFFAOYSA-N
SMILES O(C1SC2=CC=CC=C2N=1)CC(=O)N(C1C=CC=CC=1)C
CAS DataBase Reference 73250-68-7(CAS DataBase Reference)
EWG's Food Scores 1
FDA UNII QI0QTA02DG
NIST Chemistry Reference Mefenacet(73250-68-7)
EPA Substance Registry System Mefenacet (73250-68-7)

Safety

Symbol(GHS) GHS hazard pictograms
Hazard statements H411
Precautionary statements P273
Hazard Codes  N
Risk Statements  51/53
Safety Statements  61
RIDADR  UN 3077
WGK Germany  2
RTECS  AB4542550
HS Code  29342000
Toxicity LD50 in rats, mice (mg/kg): >5000, >5000 orally; >1000, >1000 s.c.; >5000, >5000 dermally; LC50 (4 hr) in rats: 134 mg/m3 (Schmidt)

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