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3-S-Isothiuronium propyl sulfonate  Structure

3-S-Isothiuronium propyl sulfonate

Chemical Properties

Melting point 240 °C
Boiling point 276.6℃ at 101.325kPa
Density  1.61±0.1 g/cm3(Predicted)
storage temp.  Keep in dark place,Inert atmosphere,Room temperature
solubility  water: soluble25mg/mL, clear, colorless
form  Solid:particulate/powder
pka 1.54±0.50(Predicted)
color  White to Almost white
biological source human
InChI InChI=1S/C4H10N2O3S2/c5-4(6)10-2-1-3-11(7,8)9/h1-3H2,(H3,5,6)(H,7,8,9)
InChIKey MQLJIOAPXLAGAP-UHFFFAOYSA-N
SMILES C(S(O)(=O)=O)CCSC(N)=N
LogP -2
Surface tension 72.9mN/m at 1g/L and 20.2℃
CAS DataBase Reference 21668-81-5(CAS DataBase Reference)
EPA Substance Registry System 1-Propanesulfonic acid, 3-[(aminoiminomethyl)thio]- (21668-81-5)

Safety Information

Hazard Codes  C,Xn
Risk Statements  34-42-36/37/38
Safety Statements  26-36/37/39-45-36/37-24-22
RIDADR  UN 3261 8/PG 2
WGK Germany  3
TSCA  TSCA listed
HazardClass  8
PackingGroup  III
HS Code  29309090
Storage Class 6.1C - Combustible acute toxic Cat.3
toxic compounds or compounds which causing chronic effects
Hazard Classifications Eye Dam. 1
Repr. 1B
Resp. Sens. 1
Skin Irrit. 2
STOT SE 3

Usage And Synthesis

Preparation Products And Raw materials

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