Vitas-M small molecule compound

3-methyl-6-phenyl-1,2,4-triazine 4-oxide

Catalog ID
STL326606
SMILES Cc1nnc(c[n+]1[O-])c1ccccc1

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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 C10H9N3O MW 187.20 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H9N3O/c1-8-11-12-10(7-13(8)14)9-5-3-2-4-6-9/h2-7H,1H3
InChIKey
BJIXGJNMHUVHDB-UHFFFAOYSA-N
Synonyms
33859-54-0
124TRIAZINE3METHYL6PHENYL4OXIDE
33859540
3METHYL4OXIDANIDYL6PHENYL124TRIAZIN4IUM
3METHYL4OXIDO6PHENYL124TRIAZIN4IUM
3METHYL6PHENYL(124)TRIAZINE4OXIDE
3methyl6phenyl124triazine4oxide
CC1=(N+)(C=C(N=N1)C2=CC=CC=C2)(O)
Cc1nnc(c(n+)1(O))c1ccccc1
InChI=1SC10H9N3Oc18111210(713(8)14)9532469h27H1H3
MFCD00493686
ZINC000000500948
ZINC00500948
ZINC500948

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Available files

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