Vitas-M small molecule compound
2-chlorophenyl 3,5-dinitrobenzoate
Catalog ID
STK413189
SMILES O=C(c1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-])Oc1ccccc1Cl
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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 C13H7ClN2O6 MW 322.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H7ClN2O6/c14-11-3-1-2-4-12(11)22-13(17)8-5-9(15(18)19)7-10(6-8)16(20)21/h1-7HInChIKey
JEZMNYHRVHWFFU-UHFFFAOYSA-NSynonyms
(2CHLOROPHENYL)35DINITROBENZOATE
2chlorophenyl35dinitrobenzoate
C1=CC=C(C(=C1)OC(=O)C2=CC(=CC(=C2)(N+)(=O)(O))(N+)(=O)(O))Cl
InChI=1SC13H7ClN2O6c1411312412(11)2213(17)859(15(18)19)710(68)16(20)21h17H
MFCD01115338
O=C(c1cc(cc(c1)(N+)(=O)(O))(N+)(=O)(O))Oc1ccccc1Cl
ZINC000005584181
ZINC05584181
ZINC5584181
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