Vitas-M small molecule compound
4-ethylphenyl 2-nitrobenzoate
Catalog ID
STK065131
SMILES CCc1ccc(cc1)OC(=O)c1ccccc1[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/c1-2-11-7-9-12(10-8-11)20-15(17)13-5-3-4-6-14(13)16(18)19/h3-10H,2H2,1H3InChIKey
HEXJNSZLXBPWDD-UHFFFAOYSA-NSynonyms
(4ETHYLPHENYL)2NITROBENZOATE
4ETHYLPHENYL2NITROBENZOATE
CCC1=CC=C(C=C1)OC(=O)C2=CC=CC=C2(N+)(=O)(O)
CCc1ccc(cc1)OC(=O)c1ccccc1(N+)(=O)(O)
InChI=1SC15H13NO4c12117912(10811)2015(17)13534614(13)16(18)19h310H2H21H3
MFCD03193765
STK065131
ZINC000000038616
ZINC00038616
ZINC38616
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