Vitas-M small molecule compound

1-[4-(4-chloro-2-nitrophenyl)piperazin-1-yl]ethanone

Catalog ID
STK021346
SMILES Clc1ccc(c(c1)[N+](=O)[O-])N1CCN(CC1)C(=O)C

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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 C12H14ClN3O3 MW 283.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H14ClN3O3/c1-9(17)14-4-6-15(7-5-14)11-3-2-10(13)8-12(11)16(18)19/h2-3,8H,4-7H2,1H3
InChIKey
DPQRIWLUJSSAEE-UHFFFAOYSA-N
Synonyms
329922-78-3
1(4(4CHLORO2NITROPHENYL)PIPERAZIN1YL)ETHANONE
1ACETYL4(4CHLORO2NITROPHENYL)PIPERAZINE
329922783
CC(=O)N1CCN(CC1)C2=C(C=C(C=C2)Cl)(N+)(=O)(O)
Clc1ccc(c(c1)(N+)(=O)(O))N1CCN(CC1)C(=O)C
InChI=1SC12H14ClN3O3c19(17)144615(7514)113210(13)812(11)16(18)19h238H47H21H3
MFCD00785202
STK021346
ZINC000004561544
ZINC04561544
ZINC4561544

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Available files

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