Vitas-M small molecule compound

2-butyl-3-methoxy-2,3-dihydro-1H-isoindol-1-one

Catalog ID
STK034201
SMILES CCCCN1C(OC)c2c(C1=O)cccc2

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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 C13H17NO2 MW 219.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H17NO2/c1-3-4-9-14-12(15)10-7-5-6-8-11(10)13(14)16-2/h5-8,13H,3-4,9H2,1-2H3
InChIKey
QRSFCYOSRUYIPJ-UHFFFAOYSA-N
Synonyms

2BUTYL3METHOXY23DIHYDRO1HISOINDOL1ONE
2BUTYL3METHOXY3HISOINDOL1ONE
CCCCN1C(C2=CC=CC=C2C1=O)OC
CCCCN1C(OC)c2c(C1=O)cccc2
InChI=1SC13H17NO2c13491412(15)10756811(10)13(14)162h5813H349H212H3
MFCD11850990
STK034201
ZINC000009144717
ZINC000020058129

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Available files

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