SITS Structure

SITS

Chemical Properties

Melting point >300°C (dec.)
storage temp.  -20°C
solubility  Soluble in water, methanol, dimethyl sulfoxide
form  powder
color  Yellow or tan-yellow
Appearance Solid Powder
ex/em λex 337 nm; λem 436 nm
λmax 336 nm
BRN  9177451
Stability Temperature sensitive - recommended storage at -20oC
Biological Applications Chloride channel blockers; anion transport inhibitors; treating cancer,glaucoma,heart diseases,viral diseases
InChIKey NPAWAMRXPHRVQY-WTVBWJGASA-L
SMILES [Na+].[Na+].CC(=O)Nc1ccc(\C=C\c2ccc(cc2S([O-])(=O)=O)N=C=S)c(c1)S([O-])(=O)=O
CAS DataBase Reference 51023-76-8(CAS DataBase Reference)
EPA Substance Registry System Benzenesulfonic acid, 5-(acetylamino)-2-[2-(4-isothiocyanato-2-sulfophenyl)ethenyl]-, disodium salt (51023-76-8)
UNSPSC Code 12352202
NACRES NA.77

Safety

Symbol(GHS) Exclamation Mark (GHS07)Health Hazard (GHS08)
Signal wordDanger
Hazard statements H302-H315-H319-H334-H335
Precautionary statements P301+P312+P330-P302+P352-P305+P351+P338
Hazard Codes  Xn
Risk Statements  22-36/37/38-42
Safety Statements  22-26-36/37
WGK Germany  3
F  8-10-21
TSCA  TSCA listed
HS Code  2930909899
Storage Class 11 - Combustible Solids
Hazard Classifications Acute Tox. 4 Oral
Eye Irrit. 2
Resp. Sens. 1
Skin Irrit. 2
STOT SE 3

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