Vitas-M small molecule compound

2-methylbenzyl 4-(1H-pyrazol-1-yl)benzoate

Catalog ID
STK780675
SMILES O=C(c1ccc(cc1)n1cccn1)OCc1ccccc1C

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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 C18H16N2O2 MW 292.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16N2O2/c1-14-5-2-3-6-16(14)13-22-18(21)15-7-9-17(10-8-15)20-12-4-11-19-20/h2-12H,13H2,1H3
InChIKey
UFWDIKURUGOCIP-UHFFFAOYSA-N
Synonyms

(2METHYLPHENYL)METHYL4PYRAZOL1YLBENZOATE
(2METHYLPHENYL)METHYL4PYRAZOLYLBENZOATE
2methylbenzyl4(1Hpyrazol1yl)benzoate
BENZOICACID4PYRAZOL1YL2METHYLBENZYLESTER
CC1=CC=CC=C1COC(=O)C2=CC=C(C=C2)N3C=CC=N3
InChI=1SC18H16N2O2c114523616(14)132218(21)157917(10815)20124111920h212H13H21H3
MFCD06013492
ZINC000001431926
ZINC01431926
ZINC1431926

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Available files

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