Vitas-M small molecule compound
1-hexadecyl-3-phenyl-1H-3,1-benzimidazol-3-ium
Catalog ID
STL321017
SMILES CCCCCCCCCCCCCCCCn1c[n+](c2c1cccc2)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 C29H43N2 MW 419.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H43N2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-20-25-30-26-31(27-21-16-15-17-22-27)29-24-19-18-23-28(29)30/h15-19,21-24,26H,2-14,20,25H2,1H3/q+1InChIKey
LFLDQGMJNMZCIJ-UHFFFAOYSA-NSynonyms
1hexadecyl3phenyl1H31benzimidazol3ium
1HEXADECYL3PHENYLBENZIMIDAZOL1IUM
3HEXADECYL1PHENYL3HBENZOIMIDAZOL1IUM
CCCCCCCCCCCCCCCC(N+)1=CN(C2=CC=CC=C21)C3=CC=CC=C3
CCCCCCCCCCCCCCCCn1c(n+)(c2c1cccc2)c1ccccc1
InChI=1SC29H43N2c12345678910111213142025302631(27211615172227)292419182328(29)30h1519212426H2142025H21H3q+1
MFCD01077664
ZINC000097997823
ZINC97997823
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