57677-80-2

Name 2-(4-METHOXYPHENYL)-1,3-THIAZOLE-4-CARBOXYLIC ACID
CAS 57677-80-2
Molecular Formula C11H9NO3S
MDL Number MFCD03791177
Molecular Weight 235.26
MOL File 57677-80-2.mol
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Chemical Properties

Melting point  176-178°C
Boiling point  449.7±51.0 °C(Predicted)
density  1.352±0.06 g/cm3(Predicted)
form  solid
pka 3.67±0.10(Predicted)
InChI 1S/C11H9NO3S/c1-15-8-4-2-7(3-5-8)10-12-9(6-16-10)11(13)14/h2-6H,1H3,(H,13,14)
InChIKey OIBLFOXWCGIRIQ-UHFFFAOYSA-N
SMILES COc1ccc(cc1)-c2nc(cs2)C(O)=O

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H315-H319-H335
Precautionary statements  P261-P280a-P304+P340-P305+P351+P338-P405-P501a
Hazard Codes  Xi,Xn
Risk Statements 
WGK Germany  WGK 3
HazardClass  IRRITANT
Storage Class 11 - Combustible Solids
Hazard Classifications Acute Tox. 4 Oral

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