17969-20-9

Name 2-[2-(4-CHLOROPHENYL)-1,3-THIAZOL-4-YL]ACETIC ACID
CAS 17969-20-9
Molecular Formula C11H8ClNO2S
MDL Number MFCD00721754
Molecular Weight 253.7
MOL File 17969-20-9.mol

Chemical Properties

Melting point  150-152°C
Boiling point  145°C (rough estimate)
density  1.2270 (rough estimate)
refractive index  1.6300 (estimate)
storage temp.  2-8°C
solubility  DMSO (Slightly), Methanol (Slightly)
form  Solid
pka 3.83±0.10(Predicted)
color  Off-White to Pale Brown
InChI 1S/C11H8ClNO2S/c12-8-3-1-7(2-4-8)11-13-9(6-16-11)5-10(14)15/h1-4,6H,5H2,(H,14,15)
InChIKey APBSKHYXXKHJFK-UHFFFAOYSA-N
SMILES OC(=O)Cc1csc(n1)-c2ccc(Cl)cc2

Safety Data

Hazard Codes  Xn
Risk Statements 
WGK Germany  WGK 3
HazardClass  IRRITANT
Storage Class 11 - Combustible Solids
Hazard Classifications Acute Tox. 4 Oral
Toxicity
LD50 in rats, mice (mg/kg): 850, 1000 orally; 250, 300 i.v. (Hepworth)

Hazard Information

Supplier

Related Products