Vitas-M small molecule compound

3,3-dichloro-1-(3-nitrophenyl)propan-1-one

Catalog ID
STL388005
SMILES ClC(CC(=O)c1cccc(c1)[N+](=O)[O-])Cl

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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 C9H7Cl2NO3 MW 248.06 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H7Cl2NO3/c10-9(11)5-8(13)6-2-1-3-7(4-6)12(14)15/h1-4,9H,5H2
InChIKey
HIOPNPJFSKHAFY-UHFFFAOYSA-N
Synonyms

33dichloro1(3nitrophenyl)propan1one
C1=CC(=CC(=C1)(N+)(=O)(O))C(=O)CC(Cl)Cl
ClC(CC(=O)c1cccc(c1)(N+)(=O)(O))Cl
InChI=1SC9H7Cl2NO3c109(11)58(13)62137(46)12(14)15h149H5H2
MFCD28952384
ZINC000105991847
ZINC105991847

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Available files

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