Vitas-M small molecule compound

4-nitro-2-[(E)-(1,3,5-triazatricyclo[3.3.1.1~3,7~]dec-7-ylimino)methyl]phenol

Catalog ID
STK011011
SMILES Oc1ccc(cc1/C=N/C12CN3CN(C2)CN(C1)C3)[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 C14H17N5O3 MW 303.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H17N5O3/c20-13-2-1-12(19(21)22)3-11(13)4-15-14-5-16-8-17(6-14)10-18(7-14)9-16/h1-4,20H,5-10H2/b15-4+
InChIKey
MBJVNSGPVKUYCI-SYZQJQIISA-N
Synonyms
330828-56-3
330828563
4nitro2((E)(135triazatricyclo(3311~37~)dec7ylimino)methyl)phenol
MFCD02061501
Oc1ccc(cc1C=NC12CN3CN(C2)CN(C1)C3)(N+)(=O)(O)
STK011011
ZINC000019324997

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Available files

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