Vitas-M small molecule compound

2-phenyl-N-[2,2,2-trichloro-1-(2,4-dinitrophenoxy)ethyl]acetamide

Catalog ID
STK808390
SMILES O=C(NC(C(Cl)(Cl)Cl)Oc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])Cc1ccccc1

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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 C16H12Cl3N3O6 MW 448.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12Cl3N3O6/c17-16(18,19)15(20-14(23)8-10-4-2-1-3-5-10)28-13-7-6-11(21(24)25)9-12(13)22(26)27/h1-7,9,15H,8H2,(H,20,23)
InChIKey
MQZULCAYPYRPHZ-UHFFFAOYSA-N
Synonyms

2phenylN(222trichloro1(24dinitrophenoxy)ethyl)acetamide
C1=CC=C(C=C1)CC(=O)NC(C(Cl)(Cl)Cl)OC2=C(C=C(C=C2)(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC16H12Cl3N3O6c1716(1819)15(2014(23)8104213510)28137611(21(24)25)912(13)22(26)27h17915H8H2(H2023)
MFCD00630293
O=C(NC(C(Cl)(Cl)Cl)Oc1ccc(cc1(N+)(=O)(O))(N+)(=O)(O))Cc1ccccc1
ZINC000003018970
ZINC000003018972

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Available files

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