Vitas-M small molecule compound

1-{3-[(6-bromo-1,3-benzodioxol-5-yl)methoxy]-4-methylphenyl}-1H-tetrazole

Catalog ID
STL506958
SMILES Cc1ccc(cc1OCc1cc2OCOc2cc1Br)n1cnnn1

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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 C16H13BrN4O3 MW 389.21 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13BrN4O3/c1-10-2-3-12(21-8-18-19-20-21)5-14(10)22-7-11-4-15-16(6-13(11)17)24-9-23-15/h2-6,8H,7,9H2,1H3
InChIKey
NRRFMWHSVNBWNV-UHFFFAOYSA-N
Synonyms

1(3((6bromo13benzodioxol5yl)methoxy)4methylphenyl)1Htetrazole
1(3((6bromo13benzodioxol5yl)methoxy)4methylphenyl)tetrazole
49875944
InChI=1SC16H13BrN4O3c1102312(21818192021)514(10)2271141516(613(11)17)2492315h268H79H21H3
MFCD31614463
ZINC000101207234

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Available files

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