Vitas-M small molecule compound

4-(3,5-dimethyl-1H-pyrazol-1-yl)benzonitrile

Catalog ID
STL414847
SMILES N#Cc1ccc(cc1)n1nc(cc1C)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 C12H11N3 MW 197.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H11N3/c1-9-7-10(2)15(14-9)12-5-3-11(8-13)4-6-12/h3-7H,1-2H3
InChIKey
BTXLPDNFEZIQBZ-UHFFFAOYSA-N
Synonyms
56935-79-6
1(4CYANOPHENYL)35DIMETHYL1HPYRAZOLE
4(35dimethyl1Hpyrazol1yl)benzonitrile
4(35DIMETHYLPYRAZOL1YL)BENZONITRILE
4(35DIMETHYLPYRAZOLYL)BENZENECARBONITRILE
56935796
CC1=CC(=NN1C2=CC=C(C=C2)C#N)C
InChI=1SC12H11N3c19710(2)15(149)125311(813)4612h37H12H3
MFCD09817559
ZINC000012370830
ZINC12370830

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Available files

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