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4-Acetoxyindole Structure

4-Acetoxyindole

Chemical Properties

Melting point 100-102°C
Boiling point 339.1±15.0 °C(Predicted)
Density  1?+-.0.06 g/cm3(Predicted)
storage temp.  2-8°C
solubility  Chloroform (Slightly), DMSO (Slightly), Methanol (Slightly)
form  Solid
pka 16.38±0.30(Predicted)
color  Off-White to Beige
InChI InChI=1S/C10H9NO2/c1-7(12)13-10-4-2-3-9-8(10)5-6-11-9/h2-6,11H,1H3
InChIKey ZXDMUHFTJWEDEF-UHFFFAOYSA-N
SMILES N1C2=C(C(OC(=O)C)=CC=C2)C=C1
CAS DataBase Reference 5585-96-6(CAS DataBase Reference)

Safety

Symbol(GHS)
Signal wordWarning
Hazard statements H302-H315-H319-H332-H335
Precautionary statements P280-P305+P351+P338-P310
Hazard Codes  Xi
WGK Germany  3
Hazard Note  Irritant
HS Code  2933998090

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