Vitas-M small molecule compound
4-chloro-3,5-dinitrobenzoic acid
Catalog ID
STK400545
SMILES [O-][N+](=O)c1cc(cc(c1Cl)[N+](=O)[O-])C(=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 C7H3ClN2O6 MW 246.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C7H3ClN2O6/c8-6-4(9(13)14)1-3(7(11)12)2-5(6)10(15)16/h1-2H,(H,11,12)InChIKey
PCTFIHOVQYYAMH-UHFFFAOYSA-NSynonyms
118-97-8(O)(N+)(=O)c1cc(cc(c1Cl)(N+)(=O)(O))C(=O)O
118978
35DINITRO4CHLOROBENZOICACID
4CHLORO35DINITROBENZENECARBOXYLATE
4CHLORO35DINITROBENZOATE
4chloro35dinitrobenzoicacid
BENZOICACID4CHLORO35DINITRO
C1=C(C=C(C(=C1(N+)(=O)(O))Cl)(N+)(=O)(O))C(=O)O
InChI=1SC7H3ClN2O6c864(9(13)14)13(7(11)12)25(6)10(15)16h12H(H1112)
MFCD00007080
ZINC000001707954
ZINC1707954
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