Vitas-M small molecule compound

1-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)propan-2-one

Catalog ID
STK312615
SMILES CC(=O)Cn1nc(c(c1C)Cl)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 C8H11ClN2O MW 186.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C8H11ClN2O/c1-5(12)4-11-7(3)8(9)6(2)10-11/h4H2,1-3H3
InChIKey
GPRISQWWWQHPQJ-UHFFFAOYSA-N
Synonyms
1001465-98-0
1(4CHLORO35DIMETHYL1HPYRAZOL1YL)ACETONE
1(4CHLORO35DIMETHYL1HPYRAZOL1YL)ACETONE95
1(4chloro35dimethyl1Hpyrazol1yl)propan2one
1(4CHLORO35DIMETHYLPYRAZOL1YL)PROPAN2ONE
1(4CHLORO35DIMETHYLPYRAZOLYL)ACETONE
1001465980
CC1=C(C(=NN1CC(=O)C)C)Cl
InChI=1SC8H11ClN2Oc15(12)4117(3)8(9)6(2)1011h4H213H3
MFCD03885076
ZINC000002518454
ZINC02518454
ZINC2518454

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Available files

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