Vitas-M small molecule compound
4-chloro-3-methylphenyl 5-nitrofuran-2-carboxylate
Catalog ID
STK378855
SMILES O=C(c1ccc(o1)[N+](=O)[O-])Oc1ccc(c(c1)C)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 C12H8ClNO5 MW 281.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H8ClNO5/c1-7-6-8(2-3-9(7)13)18-12(15)10-4-5-11(19-10)14(16)17/h2-6H,1H3InChIKey
YSSSXXWTUOODDS-UHFFFAOYSA-NSynonyms
354768-94-8(4CHLORO3METHYLPHENYL)5NITROFURAN2CARBOXYLATE
354768948
4chloro3methylphenyl5nitrofuran2carboxylate
CC1=C(C=CC(=C1)OC(=O)C2=CC=C(O2)(N+)(=O)(O))Cl
InChI=1SC12H8ClNO5c1768(239(7)13)1812(15)104511(1910)14(16)17h26H1H3
MFCD02067420
O=C(c1ccc(o1)(N+)(=O)(O))Oc1ccc(c(c1)C)Cl
ZINC000004503112
ZINC04503112
ZINC4503112
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