Vitas-M small molecule compound

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

Catalog ID
STK312661
SMILES OCn1nc(c(c1C)[N+](=O)[O-])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 C6H9N3O3 MW 171.16 g/mol Purity >90% as per NMR
InChI
InChI=1S/C6H9N3O3/c1-4-6(9(11)12)5(2)8(3-10)7-4/h10H,3H2,1-2H3
InChIKey
FNQSANZKSFZCNK-UHFFFAOYSA-N
Synonyms
139664-31-6
(35dimethyl4nitro1Hpyrazol1yl)methanol
(35DIMETHYL4NITROPYRAZOL1YL)METHANOL
(35DIMETHYL4NITROPYRAZOLYL)METHAN1OL
139664316
CC1=C(C(=NN1CO)C)(N+)(=O)(O)
InChI=1SC6H9N3O3c146(9(11)12)5(2)8(310)74h10H3H212H3
MFCD01016815
OCn1nc(c(c1C)(N+)(=O)(O))C
ZINC000002571663
ZINC02571663
ZINC2571663

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Available files

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