Vitas-M small molecule compound

3-(4-bromophenyl)-5-iodo-2,1-benzoxazole

Catalog ID
STL022556
SMILES Brc1ccc(cc1)c1onc2c1cc(I)cc2

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C13H7BrINO MW 400.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H7BrINO/c14-9-3-1-8(2-4-9)13-11-7-10(15)5-6-12(11)16-17-13/h1-7H
InChIKey
CTIUJPYZLRPHRG-UHFFFAOYSA-N
Synonyms

3(4bromophenyl)5iodo21benzoxazole
3(4BROMOPHENYL)5IODOBENZO(C)ISOXAZOLE
C1=CC(=CC=C1C2=C3C=C(C=CC3=NO2)I)Br
InChI=1SC13H7BrINOc149318(249)1311710(15)5612(11)161713h17H
MFCD07429039
ZINC000005032113
ZINC05032113
ZINC5032113

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.