Vitas-M small molecule compound

(2-methyl-3-nitrophenoxy)acetic acid

Catalog ID
STK894905
SMILES OC(=O)COc1cccc(c1C)[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 C9H9NO5 MW 211.17 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H9NO5/c1-6-7(10(13)14)3-2-4-8(6)15-5-9(11)12/h2-4H,5H2,1H3,(H,11,12)
InChIKey
APUCWHLALOFKQE-UHFFFAOYSA-N
Synonyms
328388-15-4
(2methyl3nitrophenoxy)aceticacid
2(2methyl3nitrophenoxy)aceticacid
328388154
CC1=C(C=CC=C1OCC(=O)O)(N+)(=O)(O)
InChI=1SC9H9NO5c167(10(13)14)3248(6)1559(11)12h24H5H21H3(H1112)
MFCD12169976
OC(=O)COc1cccc(c1C)(N+)(=O)(O)
ZINC000035282900
ZINC35282900

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Available files

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