Vitas-M small molecule compound

methyl 4-[(4-methyl-2-nitrophenoxy)methyl]benzoate

Catalog ID
STK312952
SMILES COC(=O)c1ccc(cc1)COc1ccc(cc1[N+](=O)[O-])C

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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 C16H15NO5 MW 301.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15NO5/c1-11-3-8-15(14(9-11)17(19)20)22-10-12-4-6-13(7-5-12)16(18)21-2/h3-9H,10H2,1-2H3
InChIKey
IYRBFQAEYXIKFQ-UHFFFAOYSA-N
Synonyms
832740-11-1
4(4METHYL2NITROPHENOXYMETHYL)BENZOICACIDME
4(4METHYL2NITROPHENOXYMETHYL)BENZOICACIDMETHYLESTER
832740111
CC1=CC(=C(C=C1)OCC2=CC=C(C=C2)C(=O)OC)(N+)(=O)(O)
COC(=O)c1ccc(cc1)COc1ccc(cc1(N+)(=O)(O))C
InChI=1SC16H15NO5c1113815(14(911)17(19)20)2210124613(7512)16(18)212h39H10H212H3
methyl4((4methyl2nitrophenoxy)methyl)benzoate
MFCD04968773
ZINC000002536616
ZINC02536616
ZINC2536616

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Available files

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