Vitas-M small molecule compound

bis[2-(4-nitrophenyl)-2-oxoethyl] 1,2,2-trimethylcyclopentane-1,3-dicarboxylate

Catalog ID
STL169082
SMILES O=C(c1ccc(cc1)[N+](=O)[O-])COC(=O)C1CCC(C1(C)C)(C)C(=O)OCC(=O)c1ccc(cc1)[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 C26H26N2O10 MW 526.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26N2O10/c1-25(2)20(23(31)37-14-21(29)16-4-8-18(9-5-16)27(33)34)12-13-26(25,3)24(32)38-15-22(30)17-6-10-19(11-7-17)28(35)36/h4-11,20H,12-15H2,1-3H3
InChIKey
HZKQMCMICFFFNB-UHFFFAOYSA-N
Synonyms

bis(2(4nitrophenyl)2oxoethyl)122trimethylcyclopentane13dicarboxylate
BIS(2(4NITROPHENYL)2OXOETHYL)CAMPHORATE
CC1(C(CCC1(C)C(=O)OCC(=O)C2=CC=C(C=C2)(N+)(=O)(O))C(=O)OCC(=O)C3=CC=C(C=C3)(N+)(=O)(O))C
InChI=1SC26H26N2O10c125(2)20(23(31)371421(29)164818(9516)27(33)34)121326(253)24(32)381522(30)1761019(11717)28(35)36h41120H1215H213H3
MFCD00311717
O=C(c1ccc(cc1)(N+)(=O)(O))COC(=O)C1CCC(C1(C)C)(C)C(=O)OCC(=O)c1ccc(cc1)(N+)(=O)(O)
ZINC000008457002
ZINC000008457007

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Available files

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