4382-53-0

Name 5-BENZYLOXYINDOLE-3-ACETIC ACID
CAS 4382-53-0
Molecular Formula C17H15NO3
MDL Number MFCD00022750
Molecular Weight 281.31
MOL File 4382-53-0.mol
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Chemical Properties

Melting point  147-149 °C(Solv: ethanol, 50% (64-17-5))
Boiling point  533.2±40.0 °C(Predicted)
density  1.314±0.06 g/cm3(Predicted)
storage temp.  2-8°C
form  crystalline
pka 4.51±0.30(Predicted)
color  off-white to tan
InChI 1S/C17H15NO3/c19-17(20)8-13-10-18-16-7-6-14(9-15(13)16)21-11-12-4-2-1-3-5-12/h1-7,9-10,18H,8,11H2,(H,19,20)
InChIKey GKIOPUYLJUOZHJ-UHFFFAOYSA-N
SMILES OC(=O)Cc1c[nH]c2ccc(OCc3ccccc3)cc12
CAS DataBase Reference 4382-53-0(CAS DataBase Reference)

Safety Data

Hazard Codes  Xi
Risk Statements 
Safety Statements 
WGK Germany  3
HS Code  2933998090
Storage Class 11 - Combustible Solids
Hazard Classifications Eye Irrit. 2
Skin Irrit. 2

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