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4790-04-9

4790-04-9 Structure

4790-04-9 Structure
IdentificationBack Directory
[Name]

5-Benzyloxy-6-methoxyindole
[CAS]

4790-04-9
[Synonyms]

NSC 92529
5-BENZYLOXY-6-METHOXYINDOLE
5-(benzyloxy)-6-methoxy-1H-indole
6-methoxy-5-(phenylmethoxy)-1H-indole
5-benzyloxy-6-methoxyindole crystalline
[Molecular Formula]

C16H15NO2
[MDL Number]

MFCD00037973
[MOL File]

4790-04-9.mol
[Molecular Weight]

253.3
Chemical PropertiesBack Directory
[Appearance]

White Solid
[Melting point ]

93-94°C
[Boiling point ]

430.9±30.0 °C(Predicted)
[density ]

1.202±0.06 g/cm3(Predicted)
[storage temp. ]

-20°C Freezer
[solubility ]

Chloroform (Slightly), Ethyl Acetate (Slightly), Methanol (Slightly)
[form ]

Solid
[pka]

16.85±0.30(Predicted)
[color ]

White to Pale Brown
[InChI]

InChI=1S/C16H15NO2/c1-18-15-10-14-13(7-8-17-14)9-16(15)19-11-12-5-3-2-4-6-12/h2-10,17H,11H2,1H3
[InChIKey]

XDLZHWUPJHWVFK-UHFFFAOYSA-N
[SMILES]

N1C2=C(C=C(OCC3=CC=CC=C3)C(OC)=C2)C=C1
Hazard InformationBack Directory
[Chemical Properties]

White Solid
[Uses]

Reactant for preparation of:
  • CB2 Cannabinoid receptor ligands
  • Potent antimitotic agents
  • Potent c-ABL inhibitors
  • Eumelanin pigment precursors
Safety DataBack Directory
[Symbol(GHS) ]

GHS hazard pictograms
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P261-P305+P351+P338
[WGK Germany ]

3
[Storage Class]

11 - Combustible Solids
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