Vitas-M small molecule compound

benzene-1,4-diyl bis(3,5-dinitrobenzoate)

Catalog ID
STK388623
SMILES O=C(c1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-])Oc1ccc(cc1)OC(=O)c1cc(cc(c1)[N+](=O)[O-])[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 C20H10N4O12 MW 498.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H10N4O12/c25-19(11-5-13(21(27)28)9-14(6-11)22(29)30)35-17-1-2-18(4-3-17)36-20(26)12-7-15(23(31)32)10-16(8-12)24(33)34/h1-10H
InChIKey
GFWCKFGTDPMRKC-UHFFFAOYSA-N
Synonyms
438540-08-0
(4(35DINITROBENZOYL)OXYPHENYL)35DINITROBENZOATE
438540080
benzene14diylbis(35dinitrobenzoate)
C1=CC(=CC=C1OC(=O)C2=CC(=CC(=C2)(N+)(=O)(O))(N+)(=O)(O))OC(=O)C3=CC(=CC(=C3)(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC20H10N4O12c2519(11513(21(27)28)914(611)22(29)30)35171218(4317)3620(26)12715(23(31)32)1016(812)24(33)34h110H
MFCD00311632
O=C(c1cc(cc(c1)(N+)(=O)(O))(N+)(=O)(O))Oc1ccc(cc1)OC(=O)c1cc(cc(c1)(N+)(=O)(O))(N+)(=O)(O)
ZINC000100349876
ZINC100349876

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Available files

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