89694-24-6

Name (2E)-3-[4-(METHYLSULFONYL)PHENYL]PROPENOIC ACID
CAS 89694-24-6
Molecular Formula C10H10O4S
MDL Number MFCD00203126
Molecular Weight 226.25
MOL File 89694-24-6.mol
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Chemical Properties

Melting point  154-156
Boiling point  440.5±40.0 °C(Predicted)
density  1.349±0.06 g/cm3(Predicted)
form  solid
pka 2.54±0.10(Predicted)
InChI 1S/C7H8N2O4/c1-12-5-3-4(7(10)11)6(13-2)9-8-5/h3H,1-2H3,(H,10,11)
InChIKey ONEYDHWMGJRWEV-UHFFFAOYSA-N
SMILES COc1cc(C(O)=O)c(OC)nn1
CAS DataBase Reference 89694-24-6(CAS DataBase Reference)

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H315-H319-H335
Precautionary statements  P280g-P305+P351+P338
Hazard Codes  Xi
Risk Statements 
R36/37/38:Irritating to eyes, respiratory system and skin .
Safety Statements 
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S37:Wear suitable gloves .
WGK Germany  WGK 3
Hazard Note  Irritant
HazardClass  IRRITANT
HS Code  2933998090
Storage Class 11 - Combustible Solids

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