Vitas-M small molecule compound

ethyl 4-(5-amino-2-fluoro-4-nitrophenyl)piperazine-1-carboxylate

Catalog ID
STK776100
SMILES CCOC(=O)N1CCN(CC1)c1cc(N)c(cc1F)[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 C13H17FN4O4 MW 312.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H17FN4O4/c1-2-22-13(19)17-5-3-16(4-6-17)11-8-10(15)12(18(20)21)7-9(11)14/h7-8H,2-6,15H2,1H3
InChIKey
ICDKGFUVZSYIMT-UHFFFAOYSA-N
Synonyms

CCOC(=O)N1CCN(CC1)c1cc(N)c(cc1F)(N+)(=O)(O)
CCOC(=O)N1CCN(CC1)C2=CC(=C(C=C2F)(N+)(=O)(O))N
ETHYL4(3AMINO6FLUORO4NITROPHENYL)PIPERAZINECARBOXYLATE
ETHYL4(5AMINO2FLUORO4NITROPHENYL)1PIPERAZINECARBOXYLATE
ethyl4(5amino2fluoro4nitrophenyl)piperazine1carboxylate
InChI=1SC13H17FN4O4c122213(19)175316(4617)11810(15)12(18(20)21)79(11)14h78H2615H21H3
MFCD05042228
ZINC000004623624
ZINC04623624
ZINC4623624

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Available files

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