Vitas-M small molecule compound

methyl 2-(morpholin-4-yl)-5-nitrobenzoate

Catalog ID
STK729622
SMILES COC(=O)c1cc(ccc1N1CCOCC1)[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 C12H14N2O5 MW 266.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H14N2O5/c1-18-12(15)10-8-9(14(16)17)2-3-11(10)13-4-6-19-7-5-13/h2-3,8H,4-7H2,1H3
InChIKey
QVXVAXLVFPLUDM-UHFFFAOYSA-N
Synonyms
83909-55-1
2MORPHOLIN4YL5NITROBENZOICACIDMETHYLESTER
83909551
COC(=O)C1=C(C=CC(=C1)(N+)(=O)(O))N2CCOCC2
COC(=O)c1cc(ccc1N1CCOCC1)(N+)(=O)(O)
InChI=1SC12H14N2O5c11812(15)1089(14(16)17)2311(10)1346197513h238H47H21H3
METHYL2(MORPHOLIN4YL)5NITROBENZOATE
METHYL2(NMORPHOLINO)5NITROBENZOATE
METHYL2MORPHOLIN4YL5NITROBENZOATE
METHYL2MORPHOLINO5NITROBENZENECARBOXYLATE
METHYL2MORPHOLINO5NITROBENZOATE
MFCD00277668
ZINC000003884509
ZINC03884509
ZINC3884509

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Available files

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