Vitas-M small molecule compound

(4-fluorophenyl)(7-nitro-2,3-dihydro-1,4-benzodioxin-6-yl)methanone

Catalog ID
STK259057
SMILES Fc1ccc(cc1)C(=O)c1cc2OCCOc2cc1[N+](=O)[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 C15H10FNO5 MW 303.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H10FNO5/c16-10-3-1-9(2-4-10)15(18)11-7-13-14(22-6-5-21-13)8-12(11)17(19)20/h1-4,7-8H,5-6H2
InChIKey
QDSKKYXGBCAYQX-UHFFFAOYSA-N
Synonyms

(4fluorophenyl)(6nitro23dihydro14benzodioxin7yl)methanone
(4fluorophenyl)(7nitro23dihydro14benzodioxin6yl)methanone
C1COC2=C(O1)C=C(C(=C2)(N+)(=O)(O))C(=O)C3=CC=C(C=C3)F
Fc1ccc(cc1)C(=O)c1cc2OCCOc2cc1(N+)(=O)(O)
InChI=1SC15H10FNO5c1610319(2410)15(18)1171314(22652113)812(11)17(19)20h1478H56H2
METHANONE(23DIHYDRO7NITRO14BENZODIOXIN6YL)(4FLUOROPHENYL)
MFCD08685732
ZINC000009028716
ZINC09028716
ZINC9028716

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Available files

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