Vitas-M small molecule compound

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

Catalog ID
STL163601
SMILES COC(=O)c1[nH]nc(c1)C(C)(C)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 C9H14N2O2 MW 182.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H14N2O2/c1-9(2,3)7-5-6(10-11-7)8(12)13-4/h5H,1-4H3,(H,10,11)
InChIKey
ITVYLUILHAMHAN-UHFFFAOYSA-N
Synonyms
152307-84-1
152307841
CC(C)(C)C1=CC(=NN1)C(=O)OC
COC(=O)c1(nH)nc(c1)C(C)(C)C
InChI=1SC9H14N2O2c19(23)756(10117)8(12)134h5H14H3(H1011)
methyl3(tertbutyl)1Hpyrazole5carboxylate
METHYL3(TERTBUTYL)PYRAZOLE5CARBOXYLATE
methyl3tertbutyl1Hpyrazole5carboxylate
METHYL5TERTBUTYL1HPYRAZOLE3CARBOXYLATE
METHYL5TERTBUTYL2HPYRAZOLE3CARBOXYLATE
MFCD00652984
ZINC000004674345
ZINC04674345
ZINC4674345

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Available files

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