Vitas-M small molecule compound

4-chlorobenzene-1,3-diyl bis(3-nitrobenzoate)

Catalog ID
STK388556
SMILES O=C(c1cccc(c1)[N+](=O)[O-])Oc1ccc(c(c1)OC(=O)c1cccc(c1)[N+](=O)[O-])Cl

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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 C20H11ClN2O8 MW 442.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H11ClN2O8/c21-17-8-7-16(30-19(24)12-3-1-5-14(9-12)22(26)27)11-18(17)31-20(25)13-4-2-6-15(10-13)23(28)29/h1-11H
InChIKey
IAVXJWAAQVSQML-UHFFFAOYSA-N
Synonyms
354796-39-7
(4CHLORO3(3NITROBENZOYL)OXYPHENYL)3NITROBENZOATE
354796397
4chlorobenzene13diylbis(3nitrobenzoate)
C1=CC(=CC(=C1)(N+)(=O)(O))C(=O)OC2=CC(=C(C=C2)Cl)OC(=O)C3=CC(=CC=C3)(N+)(=O)(O)
InChI=1SC20H11ClN2O8c21178716(3019(24)1231514(912)22(26)27)1118(17)3120(25)1342615(1013)23(28)29h111H
MFCD00223490
O=C(c1cccc(c1)(N+)(=O)(O))Oc1ccc(c(c1)OC(=O)c1cccc(c1)(N+)(=O)(O))Cl
ZINC000001313131
ZINC01313131
ZINC1313131

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Available files

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