Vitas-M small molecule compound

1-iodo-3-methoxy-5-[(E)-2-nitroethenyl]-2-(prop-2-yn-1-yloxy)benzene

Catalog ID
STL375773
SMILES C#CCOc1c(I)cc(cc1OC)/C=C/[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 C12H10INO4 MW 359.12 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H10INO4/c1-3-6-18-12-10(13)7-9(4-5-14(15)16)8-11(12)17-2/h1,4-5,7-8H,6H2,2H3/b5-4+
InChIKey
RMZAHIRBEHAFIT-SNAWJCMRSA-N
Synonyms

1iodo3methoxy5((E)2nitroethenyl)2(prop2yn1yloxy)benzene
1IODO3METHOXY5((E)2NITROETHENYL)2PROP2YNOXYBENZENE
C#CCOc1c(I)cc(cc1OC)C=C(N+)(=O)(O)
COC1=C(C(=CC(=C1)C=C(N+)(=O)(O))I)OCC#C
InChI=1SC12H10INO4c136181210(13)79(4514(15)16)811(12)172h14578H6H22H3b54+
MFCD03716509
ZINC000002820380
ZINC02820380
ZINC2820380

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Available files

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