Vitas-M small molecule compound

N-(2-methoxyphenyl)-5,7-dinitro-2,1,3-benzoxadiazol-4-amine

Catalog ID
STK369476
SMILES COc1ccccc1Nc1c(cc(c2c1non2)[N+](=O)[O-])[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 C13H9N5O6 MW 331.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H9N5O6/c1-23-10-5-3-2-4-7(10)14-11-8(17(19)20)6-9(18(21)22)12-13(11)16-24-15-12/h2-6,14H,1H3
InChIKey
XYTRBVAZSKYGBX-UHFFFAOYSA-N
Synonyms

(57DINITROBENZO(C)125OXADIAZOL4YL)(2METHOXYPHENYL)AMINE
COC1=CC=CC=C1NC2=C(C=C(C3=NON=C23)(N+)(=O)(O))(N+)(=O)(O)
COc1ccccc1Nc1c(cc(c2c1non2)(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC13H9N5O6c1231053247(10)14118(17(19)20)69(18(21)22)1213(11)16241512h2614H1H3
MFCD00382615
N(2methoxyphenyl)57dinitro213benzoxadiazol4amine
ZINC000004017569
ZINC04017569
ZINC4017569

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Available files

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