Vitas-M small molecule compound

N-(4-methylphenyl)-5,7-dinitroquinolin-8-amine

Catalog ID
STL336532
SMILES Cc1ccc(cc1)Nc1c(cc(c2c1nccc2)[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 C16H12N4O4 MW 324.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12N4O4/c1-10-4-6-11(7-5-10)18-16-14(20(23)24)9-13(19(21)22)12-3-2-8-17-15(12)16/h2-9,18H,1H3
InChIKey
XYXAGRIXTVHCNT-UHFFFAOYSA-N
Synonyms
313957-63-0
313957630
57dinitroN(ptolyl)quinolin8amine
CC1=CC=C(C=C1)NC2=C(C=C(C3=C2N=CC=C3)(N+)(=O)(O))(N+)(=O)(O)
Cc1ccc(cc1)Nc1c(cc(c2c1nccc2)(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC16H12N4O4c1104611(7510)181614(20(23)24)913(19(21)22)123281715(12)16h2918H1H3
MFCD01245747
N(4methylphenyl)57dinitroquinolin8amine
ZINC000004994773
ZINC04994773
ZINC4994773

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Available files

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