Vitas-M small molecule compound
4-ethylphenyl 4-nitrobenzoate
Catalog ID
STK049154
SMILES CCc1ccc(cc1)OC(=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 C15H13NO4 MW 271.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H13NO4/c1-2-11-3-9-14(10-4-11)20-15(17)12-5-7-13(8-6-12)16(18)19/h3-10H,2H2,1H3InChIKey
NCJIBEJPFSIQEA-UHFFFAOYSA-NSynonyms
(4ETHYLPHENYL)4NITROBENZOATE
4ETHYLPHENYL4NITROBENZOATE
CCC1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)(N+)(=O)(O)
CCc1ccc(cc1)OC(=O)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC15H13NO4c12113914(10411)2015(17)125713(8612)16(18)19h310H2H21H3
MFCD01175231
STK049154
ZINC000000038620
ZINC00038620
ZINC38620
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