Vitas-M small molecule compound

N-(4,5-dicyano-2-nitrophenyl)glycine

Catalog ID
STK727887
SMILES N#Cc1cc(NCC(=O)O)c(cc1C#N)[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 C10H6N4O4 MW 246.18 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H6N4O4/c11-3-6-1-8(13-5-10(15)16)9(14(17)18)2-7(6)4-12/h1-2,13H,5H2,(H,15,16)
InChIKey
XLCVBUSMYHEGFI-UHFFFAOYSA-N
Synonyms
274924-64-0
2((34DICYANO6NITROPHENYL)AMINO)ACETICACID
2((45dicyano2nitrophenyl)amino)aceticacid
2(45DICYANO2NITROANILINO)ACETICACID
274924640
C1=C(C(=CC(=C1NCC(=O)O)(N+)(=O)(O))C#N)C#N
InChI=1SC10H6N4O4c113618(13510(15)16)9(14(17)18)27(6)412h1213H5H2(H1516)
MFCD02041132
N#Cc1cc(NCC(=O)O)c(cc1C#N)(N+)(=O)(O)
N(45dicyano2nitrophenyl)glycine
ZINC000004819513
ZINC4819513

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Available files

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