Vitas-M small molecule compound
1,1'-hexane-1,6-diylbis{4-[hydroxy(phenyl)methyl]-3-methyl-1H-imidazol-3-ium}
Catalog ID
STK805777
SMILES C[n+]1cn(cc1C(c1ccccc1)O)CCCCCCn1c[n+](c(c1)C(c1ccccc1)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 C28H36N4O2 MW 460.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H36N4O2/c1-29-21-31(19-25(29)27(33)23-13-7-5-8-14-23)17-11-3-4-12-18-32-20-26(30(2)22-32)28(34)24-15-9-6-10-16-24/h5-10,13-16,19-22,27-28,33-34H,3-4,11-12,17-18H2,1-2H3/q+2InChIKey
AQXXFQBXCUDWBS-UHFFFAOYSA-NSynonyms
(1(6(4(HYDROXY(PHENYL)METHYL)3METHYLIMIDAZOL1IUM1YL)HEXYL)3METHYLIMIDAZOL1IUM4YL)PHENYLMETHANOL
11(hexane16diyl)bis(4(hydroxy(phenyl)methyl)3methyl1Himidazol3ium)iodide
11hexane16diylbis(4(hydroxy(phenyl)methyl)3methyl1Himidazol3ium)
33HEXANE16DIYLBIS(5(HYDROXY(PHENYL)METHYL)1METHYL1HIMIDAZOL3IUM)
C(n+)1cn(cc1(C@H)(c1ccccc1)O)CCCCCCn1c(n+)(c(c1)(C@@H)(c1ccccc1)O)C(I)(I)
C(n+)1cn(cc1C(c1ccccc1)O)CCCCCCn1c(n+)(c(c1)C(c1ccccc1)O)C
CN1C=(N+)(C=C1C(C2=CC=CC=C2)O)CCCCCC(N+)3=CN(C(=C3)C(C4=CC=CC=C4)O)C
InChI=1SC28H36N4O2c1292131(1925(29)27(33)23137581423)1711341218322026(30(2)2232)28(34)241596101624h5101316192227283334H3411121718H212H3q+2
ZINC000002307513
ZINC000016034885
Check stock
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Check stock on Vitas-MAvailable files
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