Vitas-M small molecule compound

1-(3,5-dichloro-4H-1,2,4-triazol-4-yl)propan-2-one

Catalog ID
STK273810
SMILES CC(=O)Cn1c(Cl)nnc1Cl

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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 C5H5Cl2N3O MW 194.02 g/mol Purity >90% as per NMR
InChI
InChI=1S/C5H5Cl2N3O/c1-3(11)2-10-4(6)8-9-5(10)7/h2H2,1H3
InChIKey
JRQOHPLHNWGHGI-UHFFFAOYSA-N
Synonyms
914357-30-5
1(35dichloro124triazol4yl)propan2one
1(35dichloro4H124triazol4yl)propan2one
914357305
CC(=O)CN1C(=NN=C1Cl)Cl
InChI=1SC5H5Cl2N3Oc13(11)2104(6)895(10)7h2H21H3
MFCD08706552
ZINC000009614851
ZINC09614851
ZINC9614851

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Available files

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