Vitas-M small molecule compound

N-hexyl-3,5-dinitrobenzamide

Catalog ID
STK416385
SMILES CCCCCCNC(=O)c1cc(cc(c1)[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 C13H17N3O5 MW 295.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H17N3O5/c1-2-3-4-5-6-14-13(17)10-7-11(15(18)19)9-12(8-10)16(20)21/h7-9H,2-6H2,1H3,(H,14,17)
InChIKey
ULUBCUUBHVXVDB-UHFFFAOYSA-N
Synonyms
92043-81-7
(35DINITROPHENYL)NHEXYLCARBOXAMIDE
92043817
CCCCCCNC(=O)C1=CC(=CC(=C1)(N+)(=O)(O))(N+)(=O)(O)
CCCCCCNC(=O)c1cc(cc(c1)(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC13H17N3O5c1234561413(17)10711(15(18)19)912(810)16(20)21h79H26H21H3(H1417)
MFCD00413284
Nhexyl35dinitrobenzamide
ZINC000003153481
ZINC03153481
ZINC3153481

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Available files

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