Vitas-M small molecule compound

ethyl 4-(2-chloro-4-nitrophenyl)piperazine-1-carboxylate

Catalog ID
STK736300
SMILES CCOC(=O)N1CCN(CC1)c1ccc(cc1Cl)[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 C13H16ClN3O4 MW 313.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H16ClN3O4/c1-2-21-13(18)16-7-5-15(6-8-16)12-4-3-10(17(19)20)9-11(12)14/h3-4,9H,2,5-8H2,1H3
InChIKey
NOQXJHDXJUGTFH-UHFFFAOYSA-N
Synonyms
864932-53-6
864932536
CCOC(=O)N1CCN(CC1)c1ccc(cc1Cl)(N+)(=O)(O)
CCOC(=O)N1CCN(CC1)C2=C(C=C(C=C2)(N+)(=O)(O))Cl
ethyl4(2chloro4nitrophenyl)piperazine1carboxylate
ETHYL4(2CHLORO4NITROPHENYL)PIPERAZINECARBOXYLATE
InChI=1SC13H16ClN3O4c122113(18)167515(6816)124310(17(19)20)911(12)14h349H258H21H3
MFCD07022015
ZINC000004708894
ZINC04708894
ZINC4708894

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Available files

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