536-17-4

Name 5-(4-DIMETHYLAMINOBENZYLIDENE)RHODANINE
CAS 536-17-4
EINECS(EC#) 208-625-2
Molecular Formula C12H12N2OS2
MDL Number MFCD00064857
Molecular Weight 264.37
MOL File 536-17-4.mol

Chemical Properties

Appearance red fluffy powder
Melting point  285-288 °C(lit.)
bulk density 225kg/m3
density  1.36±0.1 g/cm3 (20 ºC 760 Torr)
refractive index  1.5950 (estimate)
storage temp.  Store below +30°C.
solubility  dioxane: soluble0.1g/10 mL (hot)
form  Fluffy Powder
pka 8.17±0.30(Predicted)
color  Red
Water Solubility  Insoluble in water, 993.7(mg/L) at 25°C
λmax 451 nm
Detection Methods HPLC,NMR
Merck  14,3231
BRN  189065
InChI 1S/C12H12N2OS2/c1-14(2)9-5-3-8(4-6-9)7-10-11(15)13-12(16)17-10/h3-7H,1-2H3,(H,13,15,16)/b10-7+
InChIKey JJRVRELEASDUMY-JXMROGBWSA-N
SMILES CN(C)c1ccc(cc1)\C=C2\SC(=S)NC2=O
CAS DataBase Reference 536-17-4(CAS DataBase Reference)
EPA Substance Registry System 4-Thiazolidinone, 5-[[4-(dimethylamino)phenyl]methylene]-2-thioxo- (536-17-4)

Safety Data

Hazard Codes  Xi
Risk Statements 
R36/37/38:Irritating to eyes, respiratory system and skin .
Safety Statements 
S22:Do not breathe dust .
S24/25:Avoid contact with skin and eyes .
S36/37:Wear suitable protective clothing and gloves .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
WGK Germany  3
RTECS  VI8090000
TSCA  Yes
HazardClass  IRRITANT
HS Code  29349990
Storage Class 11 - Combustible Solids
Safety Profile
Poison by intraperitoneal route. When heated to decomposition it emits very toxic fumes of NOx and SOx

Hazard Information

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