Vitas-M small molecule compound

4-nitro-2-octyl-1H-isoindole-1,3(2H)-dione

Catalog ID
STK058401
SMILES CCCCCCCCN1C(=O)c2c(C1=O)cccc2[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 C16H20N2O4 MW 304.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H20N2O4/c1-2-3-4-5-6-7-11-17-15(19)12-9-8-10-13(18(21)22)14(12)16(17)20/h8-10H,2-7,11H2,1H3
InChIKey
GWRBFGHFCYMCFS-UHFFFAOYSA-N
Synonyms
2593-54-6
2593546
4NITRO2OCTYL1HISOINDOLE13(2H)DIONE
4NITRO2OCTYLISOINDOLE13DIONE
CCCCCCCCN1C(=O)C2=C(C1=O)C(=CC=C2)(N+)(=O)(O)
CCCCCCCCN1C(=O)c2c(C1=O)cccc2(N+)(=O)(O)
InChI=1SC16H20N2O4c1234567111715(19)12981013(18(21)22)14(12)16(17)20h810H2711H21H3
MFCD00775841
STK058401
ZINC000001599672
ZINC1599672

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Available files

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