Vitas-M small molecule compound

methyl 5-tert-butyl-1-phenyl-1H-pyrazole-3-carboxylate

Catalog ID
STL241724
SMILES COC(=O)c1nn(c(c1)C(C)(C)C)c1ccccc1

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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 C15H18N2O2 MW 258.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H18N2O2/c1-15(2,3)13-10-12(14(18)19-4)16-17(13)11-8-6-5-7-9-11/h5-10H,1-4H3
InChIKey
VCFCBBMQBIPCGL-UHFFFAOYSA-N
Synonyms
1322605-01-5
1322605015
CC(C)(C)C1=CC(=NN1C2=CC=CC=C2)C(=O)OC
InChI=1SC15H18N2O2c115(23)131012(14(18)194)1617(13)118657911h510H14H3
METHYL5(TERTBUTYL)1PHENYL1HPYRAZOLE3CARBOXYLATE
methyl5tertbutyl1phenyl1Hpyrazole3carboxylate
methyl5tertbutyl1phenylpyrazole3carboxylate
MFCD00817562
ZINC000058410428
ZINC58410428

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Available files

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