Vitas-M small molecule compound

[1-(3,5-dimethylphenyl)-1H-1,2,3-triazole-4,5-diyl]dimethanol

Catalog ID
STL145055
SMILES OCc1c(CO)nnn1c1cc(C)cc(c1)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 C12H15N3O2 MW 233.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H15N3O2/c1-8-3-9(2)5-10(4-8)15-12(7-17)11(6-16)13-14-15/h3-5,16-17H,6-7H2,1-2H3
InChIKey
XMHABHCENHSTGO-UHFFFAOYSA-N
Synonyms
1351398-99-6
(1(35dimethylphenyl)1H123triazole45diyl)dimethanol
(1(35dimethylphenyl)5(hydroxymethyl)triazol4yl)methanol
1351398996
CC1=CC(=CC(=C1)N2C(=C(N=N2)CO)CO)C
InChI=1SC12H15N3O2c1839(2)510(48)1512(717)11(616)131415h351617H67H212H3
MFCD20528987
ZINC000071289336
ZINC71289336

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Available files

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