Vitas-M small molecule compound

7-bromo-4-butyl-4,5-dihydro-1,4-benzoxazepin-3(2H)-one

Catalog ID
STL130234
SMILES CCCCN1Cc2cc(Br)ccc2OCC1=O

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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 C13H16BrNO2 MW 298.18 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H16BrNO2/c1-2-3-6-15-8-10-7-11(14)4-5-12(10)17-9-13(15)16/h4-5,7H,2-3,6,8-9H2,1H3
InChIKey
GLUYHWQKLFXNAC-UHFFFAOYSA-N
Synonyms
1326942-58-8
7bromo4butyl45dihydro14benzoxazepin3(2H)one
7bromo4butyl5H14benzoxazepin3one
CCCCN1CC2=C(C=CC(=C2)Br)OCC1=O
Registry IDs
MFCD20749666
ZINC000065184418
ZINC65184418

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Available files

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