Vitas-M small molecule compound

2-(4-fluorobenzyl)-3-methoxy-2,3,4,5,6,7-hexahydro-1H-isoindol-1-one

Catalog ID
STK002597
SMILES COC1N(Cc2ccc(cc2)F)C(=O)C2=C1CCCC2

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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 C16H18FNO2 MW 275.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18FNO2/c1-20-16-14-5-3-2-4-13(14)15(19)18(16)10-11-6-8-12(17)9-7-11/h6-9,16H,2-5,10H2,1H3
InChIKey
SARNRZFDZWHVRZ-UHFFFAOYSA-N
Synonyms

2((4fluorophenyl)methyl)3methoxy4567tetrahydro3Hisoindol1one
2(4fluorobenzyl)3methoxy234567hexahydro1Hisoindol1one
COC1C2=C(CCCC2)C(=O)N1CC3=CC=C(C=C3)F
COC1N(Cc2ccc(cc2)F)C(=O)C2=C1CCCC2
InChI=1SC16H18FNO2c1201614532413(14)15(19)18(16)10116812(17)9711h6916H2510H21H3
MFCD11850903
STK002597
ZINC000008916175
ZINC000008916176

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Available files

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