53501-41-0

Name N-[[(3-Chloro-2-hydroxy-5-nitrophenyl)amino]thioxomethyl]benzamide
CAS 53501-41-0
Molecular Formula C14H10ClN3O4S
MDL Number MFCD00761149
Molecular Weight 351.76
MOL File 53501-41-0.mol

Chemical Properties

density  1.592
storage temp.  Store at +4°C
solubility  DMSO: ≥14mg/mL
form  powder
pka 4.44±0.50(Predicted)
color  white to tan
Stability: Stable for 1 year from date of purchase as supplied. Solutions in DMSO or ethanol may be stored at -20°C for up to 2 months.
InChI 1S/C14H10ClN3O4S/c15-10-6-9(18(21)22)7-11(12(10)19)16-14(23)17-13(20)8-4-2-1-3-5-8/h1-7,19H,(H2,16,17,20,23)
InChIKey RIGXBXPAOGDDIG-UHFFFAOYSA-N
SMILES S=C(Nc2c(c(cc(c2)[N+](=O)[O-])Cl)O)NC(=O)c1ccccc1

Safety Data

Hazard Codes  Xn,N
Risk Statements 
Safety Statements 
RIDADR  UN 3077 9 / PGIII
WGK Germany  3
Storage Class 11 - Combustible Solids
Hazard Classifications Acute Tox. 4 Oral
Aquatic Acute 1

Hazard Information

Supplier