Vitas-M small molecule compound

5-chloro-2-[hydroxy(phenyl)methyl]-1,3-dimethyl-1H-imidazol-3-ium

Catalog ID
STK824562
SMILES C[n+]1cc(n(c1C(c1ccccc1)O)C)Cl

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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 C12H14ClN2O MW 237.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H14ClN2O/c1-14-8-10(13)15(2)12(14)11(16)9-6-4-3-5-7-9/h3-8,11,16H,1-2H3/q+1
InChIKey
HCBFIFGBEOKNNB-UHFFFAOYSA-N
Synonyms

(4CHLORO13DIMETHYLIMIDAZOL1IUM2YL)PHENYLMETHANOL
5chloro2(hydroxy(phenyl)methyl)13dimethyl1Himidazol3ium
5chloro2(hydroxy(phenyl)methyl)13dimethyl1Himidazol3iumiodide
C(n+)1cc(n(c1C(c1ccccc1)O)C)Cl
C(n+)1cc(n(c1C(c1ccccc1)O)C)Cl(I)
CN1C(=C(N+)(=C1C(C2=CC=CC=C2)O)C)Cl
InChI=1SC12H14ClN2Oc114810(13)15(2)12(14)11(16)9643579h381116H12H3q+1
ZINC000000231568
ZINC000000231570

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Available files

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