Vitas-M small molecule compound

2-(acetylamino)-5-nitrophenyl acetate

Catalog ID
STK051843
SMILES CC(=O)Nc1ccc(cc1OC(=O)C)[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 C10H10N2O5 MW 238.20 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H10N2O5/c1-6(13)11-9-4-3-8(12(15)16)5-10(9)17-7(2)14/h3-5H,1-2H3,(H,11,13)
InChIKey
BRCXEYUOIPWVCU-UHFFFAOYSA-N
Synonyms
304667-95-6
(2ACETAMIDO5NITROPHENYL)ACETATE
2(ACETYLAMINO)5NITROPHENYLACETATE
2ACETAMIDO5NITROPHENYLACETATE
304667956
ACETICACID2ACETYLAMINO5NITROPHENYLESTER
CC(=O)NC1=C(C=C(C=C1)(N+)(=O)(O))OC(=O)C
CC(=O)Nc1ccc(cc1OC(=O)C)(N+)(=O)(O)
InChI=1SC10H10N2O5c16(13)119438(12(15)16)510(9)177(2)14h35H12H3(H1113)
MFCD01047366
STK051843
ZINC000004656667
ZINC04656667
ZINC4656667

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Available files

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