Vitas-M small molecule compound

1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethanone

Catalog ID
STK917772
SMILES CC(=O)c1ccc2c(c1)OCCCO2

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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 C11H12O3 MW 192.21 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H12O3/c1-8(12)9-3-4-10-11(7-9)14-6-2-5-13-10/h3-4,7H,2,5-6H2,1H3
InChIKey
VGRSZNPWUZDPCH-UHFFFAOYSA-N
Synonyms
22776-09-6
(34DIHYDRO2H15BENZODIOXEPIN7YL)ETHAN1ONE
1(34DIHYDRO2H15BENZODIOXEPIN7YL)ETHAN1ONE
1(34dihydro2H15benzodioxepin7yl)ethanone
1(34dihydro2Hbenzo(b)(14)dioxepin7yl)ethanone
1(34DIHYDRO2HBENZO(B)14DIOXEPIN7YL)ETHANONE
22776096
34TRIMETHYLENEDIOXYACETOPHE
7ACETYL2H3H4HBENZO(B)14DIOXEPIN
7ACETYL34DIHYDRO15BENZODIOXEPIN
7ACETYL34DIHYDRO2H15BENZODIOXEPIN
CC(=O)C1=CC2=C(C=C1)OCCCO2
ETHANONE1(34DIHYDRO2H15BENZODIOXEPIN7YL)
InChI=1SC11H12O3c18(12)9341011(79)146251310h347H256H21H3
MFCD00114700
ZINC000004200308
ZINC04200308
ZINC4200308

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Available files

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