Vitas-M small molecule compound

1-(2-chlorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethanone

Catalog ID
STK503737
SMILES O=C(c1ccccc1Cl)Cn1cncn1

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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 C10H8ClN3O MW 221.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H8ClN3O/c11-9-4-2-1-3-8(9)10(15)5-14-7-12-6-13-14/h1-4,6-7H,5H2
InChIKey
JTBDEWHKDWCHEC-UHFFFAOYSA-N
Synonyms
60850-73-9
1(2CHLOROPHENYL)2(124)TRIAZOL1YLETHANONE
1(2CHLOROPHENYL)2(124TRIAZOL1YL)ETHANONE
1(2CHLOROPHENYL)2(1H124TRIAZOL1YL)ETHAN1ONE
1(2chlorophenyl)2(1H124triazol1yl)ethanone
1(2chlorophenyl)2(1H124triazol1yl)ethanonehydrochloride
1(2CHLOROPHENYL)2(1H124TRIAZOLE1YL)ETHANONE
60850739
C1=CC=C(C(=C1)C(=O)CN2C=NC=N2)Cl
InChI=1SC10H8ClN3Oc11942138(9)10(15)51471261314h1467H5H2
MFCD00624192
O=C(c1ccccc1Cl)Cn1cncn1Cl
ZINC000000175027
ZINC00175027
ZINC175027

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Available files

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