Vitas-M small molecule compound

2-nitrophenyl 3-methylbenzoate

Catalog ID
STK033135
SMILES Cc1cccc(c1)C(=O)Oc1ccccc1[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 C14H11NO4 MW 257.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H11NO4/c1-10-5-4-6-11(9-10)14(16)19-13-8-3-2-7-12(13)15(17)18/h2-9H,1H3
InChIKey
FCSPFCCVCHCVJE-UHFFFAOYSA-N
Synonyms

(2NITROPHENYL)3METHYLBENZOATE
2NITROPHENYL3METHYLBENZOATE
CC1=CC=CC(=C1)C(=O)OC2=CC=CC=C2(N+)(=O)(O)
Cc1cccc(c1)C(=O)Oc1ccccc1(N+)(=O)(O)
InChI=1SC14H11NO4c11054611(910)14(16)1913832712(13)15(17)18h29H1H3
MFCD03193841
STK033135
ZINC000000358436
ZINC00358436
ZINC358436

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.