bis[3,5-bis(trifluoromethyl)phenyl]-(3-methyl-2H-imidazol-2-ylium-1-yl)-pyrazol-1-ylboranuide;bis(4-fluorophenyl)-bis(3-methyl-2H-imidazol-2-ylium-1-yl)boranuide;bis(4-fluorophenyl)-(3-methyl-2H-imidazol-2-ylium-1-yl)-pyrazol-1-ylboranuide;bis(3-methyl-2H-imidazol-2-ylium-1-yl)-bis(4-methylphenyl)boranuide;diethyl-(3-methyl-2H-imidazol-2-ylium-1-yl)-pyrazol-1-ylboranuide;decakis(iridium);(3-methyl-2H-imidazol-2-ylium-1-yl)-bis(4-methylphenyl)-pyrazol-1-ylboranuide;(3-methyl-2H-imidazol-2-ylium-1-yl)-diphenyl-pyrazol-1-ylboranuide;(3-methyl-2H-imidazol-2-ylium-1-yl)-tri(pyrazol-1-yl)boranuide;1-methyl-3-[8-(3-methyl-2H-imidazol-2-ylium-1-yl)-8-boranuidatricyclo[7.4.0.02,7]trideca-1(13),2,4,6,9,11-hexaen-8-yl]-2H-imidazol-2-ylium;1-methyl-3-[8-(3-methyl-2H-imidazol-2-ylium-1-yl)-7,9-dioxa-8-boranuidabicyclo[4.3.0]nona-1,3,5-trien-8-yl]-2H-imidazol-2-ylium;decakis(2-phenylpyridine)

C292H270B10F16Ir10N54O2-6 — CID 158252794

IUPACbis[3,5-bis(trifluoromethyl)phenyl]-(3-methyl-2H-imidazol-2-ylium-1-yl)-pyrazol-1-ylboranuide;bis(4-fluorophenyl)-bis(3-methyl-2H-imidazol-2-ylium-1-yl)boranuide;bis(4-fluorophenyl)-(3-methyl-2H-imidazol-2-ylium-1-yl)-pyrazol-1-ylboranuide;bis(3-methyl-2H-imidazol-2-ylium-1-yl)-bis(4-methylphenyl)boranuide;diethyl-(3-methyl-2H-imidazol-2-ylium-1-yl)-pyrazol-1-ylboranuide;decakis(iridium);(3-methyl-2H-imidazol-2-ylium-1-yl)-bis(4-methylphenyl)-pyrazol-1-ylboranuide;(3-methyl-2H-imidazol-2-ylium-1-yl)-diphenyl-pyrazol-1-ylboranuide;(3-methyl-2H-imidazol-2-ylium-1-yl)-tri(pyrazol-1-yl)boranuide;1-methyl-3-[8-(3-methyl-2H-imidazol-2-ylium-1-yl)-8-boranuidatricyclo[7.4.0.02,7]trideca-1(13),2,4,6,9,11-hexaen-8-yl]-2H-imidazol-2-ylium;1-methyl-3-[8-(3-methyl-2H-imidazol-2-ylium-1-yl)-7,9-dioxa-8-boranuidabicyclo[4.3.0]nona-1,3,5-trien-8-yl]-2H-imidazol-2-ylium;decakis(2-phenylpyridine)
SMILESCC[B-](CC)(n1ccn(C)[cH+]1)n1cccn1.Cc1ccc([B-](c2ccc(C)cc2)(n2ccn(C)[cH+]2)n2cccn2)cc1.Cc1ccc([B-](c2ccc(C)cc2)(n2ccn(C)[cH+]2)n2ccn(C)[cH+]2)cc1.Cn1ccn([B-](c2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2cc(C(F)(F)F)cc(C(F)(F)F)c2)n2cccn2)[cH+]1.Cn1ccn([B-](c2ccc(F)cc2)(c2ccc(F)cc2)n2cccn2)[cH+]1.Cn1ccn([B-](c2ccc(F)cc2)(c2ccc(F)cc2)n2ccn(C)[cH+]2)[cH+]1.Cn1ccn([B-](c2ccccc2)(c2ccccc2)n2cccn2)[cH+]1.Cn1ccn([B-](n2cccn2)(n2cccn2)n2cccn2)[cH+]1.Cn1ccn([B-]2(n3ccn(C)[cH+]3)Oc3ccccc3O2)[cH+]1.Cn1ccn([B-]2(n3ccn(C)[cH+]3)c3ccccc3-c3ccccc32)[cH+]1.[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1
InChIInChI=1S/C23H15BF12N4.C22H26BN4.C21H23BN4.C20H20BF2N4.C20H20BN4.C19H17BF2N4.C19H19BN4.C14H16BN4O2.C13H15BN8.C11H19BN4.10C11H8N.10Ir/c1-38-5-6-39(13-38)24(40-4-2-3-37-40,18-9-14(20(25,26)27)7-15(10-18)21(28,29)30)19-11-16(22(31,32)33)8-17(12-19)23(34,35)36;1-19-5-9-21(10-6-19)23(26-15-13-24(3)17-26,27-16-14-25(4)18-27)22-11-7-20(2)8-12-22;1-18-5-9-20(10-6-18)22(26-14-4-13-23-26,25-16-15-24(3)17-25)21-11-7-19(2)8-12-21;1-24-11-13-26(15-24)21(27-14-12-25(2)16-27,17-3-7-19(22)8-4-17)18-5-9-20(23)10-6-18;1-22-11-13-24(15-22)21(25-14-12-23(2)16-25)19-9-5-3-7-17(19)18-8-4-6-10-20(18)21;1-24-13-14-25(15-24)20(26-12-2-11-23-26,16-3-7-18(21)8-4-16)17-5-9-19(22)10-6-17;1-22-15-16-23(17-22)20(24-14-8-13-21-24,18-9-4-2-5-10-18)19-11-6-3-7-12-19;1-16-7-9-18(11-16)15(19-10-8-17(2)12-19)20-13-5-3-4-6-14(13)21-15;1-18-11-12-19(13-18)14(20-8-2-5-15-20,21-9-3-6-16-21)22-10-4-7-17-22;1-4-12(5-2,16-8-6-7-13-16)15-10-9-14(3)11-15;10*1-2-6-10(7-3-1)11-8-4-5-9-12-11;;;;;;;;;;/h2-13H,1H3;5-18H,1-4H3;4-17H,1-3H3;3-16H,1-2H3;3-16H,1-2H3;2-15H,1H3;2-17H,1H3;3-12H,1-2H3;2-13H,1H3;6-11H,4-5H2,1-3H3;10*1-6,8-9H;;;;;;;;;;/q;+1;;2*+1;;;+1;;;10*-1;;;;;;;;;;
InChIKeyJVZCTHMKHVYNRO-UHFFFAOYSA-N
MW6902.01 g/mol
LogP50.32
Rot. Bonds46

About bis[3,5-bis(trifluoromethyl)phenyl]-(3-methyl-2H-imidazol-2-ylium-1-yl)-pyrazol-1-ylboranuide;bis(4-fluorophenyl)-bis(3-methyl-2H-imidazol-2-ylium-1-yl)boranuide;bis(4-fluorophenyl)-(3-methyl-2H-imidazol-2-ylium-1-yl)-pyrazol-1-ylboranuide;bis(3-methyl-2H-imidazol-2-ylium-1-yl)-bis(4-methylphenyl)boranuide;diethyl-(3-methyl-2H-imidazol-2-ylium-1-yl)-pyrazol-1-ylboranuide;decakis(iridium);(3-methyl-2H-imidazol-2-ylium-1-yl)-bis(4-methylphenyl)-pyrazol-1-ylboranuide;(3-methyl-2H-imidazol-2-ylium-1-yl)-diphenyl-pyrazol-1-ylboranuide;(3-methyl-2H-imidazol-2-ylium-1-yl)-tri(pyrazol-1-yl)boranuide;1-methyl-3-[8-(3-methyl-2H-imidazol-2-ylium-1-yl)-8-boranuidatricyclo[7.4.0.02,7]trideca-1(13),2,4,6,9,11-hexaen-8-yl]-2H-imidazol-2-ylium;1-methyl-3-[8-(3-methyl-2H-imidazol-2-ylium-1-yl)-7,9-dioxa-8-boranuidabicyclo[4.3.0]nona-1,3,5-trien-8-yl]-2H-imidazol-2-ylium;decakis(2-phenylpyridine)

bis[3,5-bis(trifluoromethyl)phenyl]-(3-methyl-2H-imidazol-2-ylium-1-yl)-pyrazol-1-ylboranuide;bis(4-fluorophenyl)-bis(3-methyl-2H-imidazol-2-ylium-1-yl)boranuide;bis(4-fluorophenyl)-(3-methyl-2H-imidazol-2-ylium-1-yl)-pyrazol-1-ylboranuide;bis(3-methyl-2H-imidazol-2-ylium-1-yl)-bis(4-methylphenyl)boranuide;diethyl-(3-methyl-2H-imidazol-2-ylium-1-yl)-pyrazol-1-ylboranuide;decakis(iridium);(3-methyl-2H-imidazol-2-ylium-1-yl)-bis(4-methylphenyl)-pyrazol-1-ylboranuide;(3-methyl-2H-imidazol-2-ylium-1-yl)-diphenyl-pyrazol-1-ylboranuide;(3-methyl-2H-imidazol-2-ylium-1-yl)-tri(pyrazol-1-yl)boranuide;1-methyl-3-[8-(3-methyl-2H-imidazol-2-ylium-1-yl)-8-boranuidatricyclo[7.4.0.02,7]trideca-1(13),2,4,6,9,11-hexaen-8-yl]-2H-imidazol-2-ylium;1-methyl-3-[8-(3-methyl-2H-imidazol-2-ylium-1-yl)-7,9-dioxa-8-boranuidabicyclo[4.3.0]nona-1,3,5-trien-8-yl]-2H-imidazol-2-ylium;decakis(2-phenylpyridine) (PubChem CID 158252794) has the molecular formula C292H270B10F16Ir10N54O2-6 and a molecular weight of 6902.01 g/mol. Its IUPAC name is bis[3,5-bis(trifluoromethyl)phenyl]-(3-methyl-2H-imidazol-2-ylium-1-yl)-pyrazol-1-ylboranuide;bis(4-fluorophenyl)-bis(3-methyl-2H-imidazol-2-ylium-1-yl)boranuide;bis(4-fluorophenyl)-(3-methyl-2H-imidazol-2-ylium-1-yl)-pyrazol-1-ylboranuide;bis(3-methyl-2H-imidazol-2-ylium-1-yl)-bis(4-methylphenyl)boranuide;diethyl-(3-methyl-2H-imidazol-2-ylium-1-yl)-pyrazol-1-ylboranuide;decakis(iridium);(3-methyl-2H-imidazol-2-ylium-1-yl)-bis(4-methylphenyl)-pyrazol-1-ylboranuide;(3-methyl-2H-imidazol-2-ylium-1-yl)-diphenyl-pyrazol-1-ylboranuide;(3-methyl-2H-imidazol-2-ylium-1-yl)-tri(pyrazol-1-yl)boranuide;1-methyl-3-[8-(3-methyl-2H-imidazol-2-ylium-1-yl)-8-boranuidatricyclo[7.4.0.02,7]trideca-1(13),2,4,6,9,11-hexaen-8-yl]-2H-imidazol-2-ylium;1-methyl-3-[8-(3-methyl-2H-imidazol-2-ylium-1-yl)-7,9-dioxa-8-boranuidabicyclo[4.3.0]nona-1,3,5-trien-8-yl]-2H-imidazol-2-ylium;decakis(2-phenylpyridine).

Molecular Properties

Compound Namebis[3,5-bis(trifluoromethyl)phenyl]-(3-methyl-2H-imidazol-2-ylium-1-yl)-pyrazol-1-ylboranuide;bis(4-fluorophenyl)-bis(3-methyl-2H-imidazol-2-ylium-1-yl)boranuide;bis(4-fluorophenyl)-(3-methyl-2H-imidazol-2-ylium-1-yl)-pyrazol-1-ylboranuide;bis(3-methyl-2H-imidazol-2-ylium-1-yl)-bis(4-methylphenyl)boranuide;diethyl-(3-methyl-2H-imidazol-2-ylium-1-yl)-pyrazol-1-ylboranuide;decakis(iridium);(3-methyl-2H-imidazol-2-ylium-1-yl)-bis(4-methylphenyl)-pyrazol-1-ylboranuide;(3-methyl-2H-imidazol-2-ylium-1-yl)-diphenyl-pyrazol-1-ylboranuide;(3-methyl-2H-imidazol-2-ylium-1-yl)-tri(pyrazol-1-yl)boranuide;1-methyl-3-[8-(3-methyl-2H-imidazol-2-ylium-1-yl)-8-boranuidatricyclo[7.4.0.02,7]trideca-1(13),2,4,6,9,11-hexaen-8-yl]-2H-imidazol-2-ylium;1-methyl-3-[8-(3-methyl-2H-imidazol-2-ylium-1-yl)-7,9-dioxa-8-boranuidabicyclo[4.3.0]nona-1,3,5-trien-8-yl]-2H-imidazol-2-ylium;decakis(2-phenylpyridine)
PubChem CID158252794
Molecular FormulaC292H270B10F16Ir10N54O2-6
Molecular Weight6902.01 g/mol
Exact Mass6907.97
IUPAC Namebis[3,5-bis(trifluoromethyl)phenyl]-(3-methyl-2H-imidazol-2-ylium-1-yl)-pyrazol-1-ylboranuide;bis(4-fluorophenyl)-bis(3-methyl-2H-imidazol-2-ylium-1-yl)boranuide;bis(4-fluorophenyl)-(3-methyl-2H-imidazol-2-ylium-1-yl)-pyrazol-1-ylboranuide;bis(3-methyl-2H-imidazol-2-ylium-1-yl)-bis(4-methylphenyl)boranuide;diethyl-(3-methyl-2H-imidazol-2-ylium-1-yl)-pyrazol-1-ylboranuide;decakis(iridium);(3-methyl-2H-imidazol-2-ylium-1-yl)-bis(4-methylphenyl)-pyrazol-1-ylboranuide;(3-methyl-2H-imidazol-2-ylium-1-yl)-diphenyl-pyrazol-1-ylboranuide;(3-methyl-2H-imidazol-2-ylium-1-yl)-tri(pyrazol-1-yl)boranuide;1-methyl-3-[8-(3-methyl-2H-imidazol-2-ylium-1-yl)-8-boranuidatricyclo[7.4.0.02,7]trideca-1(13),2,4,6,9,11-hexaen-8-yl]-2H-imidazol-2-ylium;1-methyl-3-[8-(3-methyl-2H-imidazol-2-ylium-1-yl)-7,9-dioxa-8-boranuidabicyclo[4.3.0]nona-1,3,5-trien-8-yl]-2H-imidazol-2-ylium;decakis(2-phenylpyridine)
SMILESCC[B-](CC)(n1ccn(C)[cH+]1)n1cccn1.Cc1ccc([B-](c2ccc(C)cc2)(n2ccn(C)[cH+]2)n2cccn2)cc1.Cc1ccc([B-](c2ccc(C)cc2)(n2ccn(C)[cH+]2)n2ccn(C)[cH+]2)cc1.Cn1ccn([B-](c2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2cc(C(F)(F)F)cc(C(F)(F)F)c2)n2cccn2)[cH+]1.Cn1ccn([B-](c2ccc(F)cc2)(c2ccc(F)cc2)n2cccn2)[cH+]1.Cn1ccn([B-](c2ccc(F)cc2)(c2ccc(F)cc2)n2ccn(C)[cH+]2)[cH+]1.Cn1ccn([B-](c2ccccc2)(c2ccccc2)n2cccn2)[cH+]1.Cn1ccn([B-](n2cccn2)(n2cccn2)n2cccn2)[cH+]1.Cn1ccn([B-]2(n3ccn(C)[cH+]3)Oc3ccccc3O2)[cH+]1.Cn1ccn([B-]2(n3ccn(C)[cH+]3)c3ccccc3-c3ccccc32)[cH+]1.[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1
InChIInChI=1S/C23H15BF12N4.C22H26BN4.C21H23BN4.C20H20BF2N4.C20H20BN4.C19H17BF2N4.C19H19BN4.C14H16BN4O2.C13H15BN8.C11H19BN4.10C11H8N.10Ir/c1-38-5-6-39(13-38)24(40-4-2-3-37-40,18-9-14(20(25,26)27)7-15(10-18)21(28,29)30)19-11-16(22(31,32)33)8-17(12-19)23(34,35)36;1-19-5-9-21(10-6-19)23(26-15-13-24(3)17-26,27-16-14-25(4)18-27)22-11-7-20(2)8-12-22;1-18-5-9-20(10-6-18)22(26-14-4-13-23-26,25-16-15-24(3)17-25)21-11-7-19(2)8-12-21;1-24-11-13-26(15-24)21(27-14-12-25(2)16-27,17-3-7-19(22)8-4-17)18-5-9-20(23)10-6-18;1-22-11-13-24(15-22)21(25-14-12-23(2)16-25)19-9-5-3-7-17(19)18-8-4-6-10-20(18)21;1-24-13-14-25(15-24)20(26-12-2-11-23-26,16-3-7-18(21)8-4-16)17-5-9-19(22)10-6-17;1-22-15-16-23(17-22)20(24-14-8-13-21-24,18-9-4-2-5-10-18)19-11-6-3-7-12-19;1-16-7-9-18(11-16)15(19-10-8-17(2)12-19)20-13-5-3-4-6-14(13)21-15;1-18-11-12-19(13-18)14(20-8-2-5-15-20,21-9-3-6-16-21)22-10-4-7-17-22;1-4-12(5-2,16-8-6-7-13-16)15-10-9-14(3)11-15;10*1-2-6-10(7-3-1)11-8-4-5-9-12-11;;;;;;;;;;/h2-13H,1H3;5-18H,1-4H3;4-17H,1-3H3;3-16H,1-2H3;3-16H,1-2H3;2-15H,1H3;2-17H,1H3;3-12H,1-2H3;2-13H,1H3;6-11H,4-5H2,1-3H3;10*1-6,8-9H;;;;;;;;;;/q;+1;;2*+1;;;+1;;;10*-1;;;;;;;;;;
InChIKeyJVZCTHMKHVYNRO-UHFFFAOYSA-N
XLogP50.32
TPSA427.96 Ų
H-Bond Donors
H-Bond Acceptors56
Rotatable Bonds46
Heavy Atoms384
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5006902.01
LogP ≤ 550.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1056

Analyze bis[3,5-bis(trifluoromethyl)phenyl]-(3-methyl-2H-imidazol-2-ylium-1-yl)-pyrazol-1-ylboranuide;bis(4-fluorophenyl)-bis(3-methyl-2H-imidazol-2-ylium-1-yl)boranuide;bis(4-fluorophenyl)-(3-methyl-2H-imidazol-2-ylium-1-yl)-pyrazol-1-ylboranuide;bis(3-methyl-2H-imidazol-2-ylium-1-yl)-bis(4-methylphenyl)boranuide;diethyl-(3-methyl-2H-imidazol-2-ylium-1-yl)-pyrazol-1-ylboranuide;decakis(iridium);(3-methyl-2H-imidazol-2-ylium-1-yl)-bis(4-methylphenyl)-pyrazol-1-ylboranuide;(3-methyl-2H-imidazol-2-ylium-1-yl)-diphenyl-pyrazol-1-ylboranuide;(3-methyl-2H-imidazol-2-ylium-1-yl)-tri(pyrazol-1-yl)boranuide;1-methyl-3-[8-(3-methyl-2H-imidazol-2-ylium-1-yl)-8-boranuidatricyclo[7.4.0.02,7]trideca-1(13),2,4,6,9,11-hexaen-8-yl]-2H-imidazol-2-ylium;1-methyl-3-[8-(3-methyl-2H-imidazol-2-ylium-1-yl)-7,9-dioxa-8-boranuidabicyclo[4.3.0]nona-1,3,5-trien-8-yl]-2H-imidazol-2-ylium;decakis(2-phenylpyridine) with MolForge

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Related Compounds

bis[3,5-bis(trifluoromethyl)phenyl]-bis(3-methyl-2H-imidazol-2-ylium-1-yl)boranuide;bis(3-methyl-2H-imidazol-2-ylium-1-yl)-diphenylboranuide;bis(3-methyl-2H-imidazol-2-ylium-1-yl)-di(pyrazol-1-yl)boranuide;diethyl-bis(3-methyl-2H-imidazol-2-ylium-1-yl)boranuide;octakis(iridium);(3-methyl-2H-imidazol-1-ium-2-id-1-yl)-pyrazol-2-ium-1-id-2-yl-di(pyrazol-1-yl)boranuide;(3-methyl-2H-imidazol-1-ium-2-id-1-yl)-tri(pyrazol-1-yl)boranuide;(3-methyl-2H-imidazol-2-ylium-1-yl)-pyrazol-2-ium-1-id-2-yl-di(pyrazol-1-yl)boranuide;(3-methyl-2H-imidazol-2-ylium-1-yl)-tri(pyrazol-1-yl)boranuide;octakis(2-phenylpyridine)
CID 158027745
bis(bis[3,5-bis(trifluoromethyl)phenyl]-bis(3-methyl-2H-imidazol-2-ylium-1-yl)boranuide);bis(4-fluorophenyl)-bis(3-methyl-2H-imidazol-2-ylium-1-yl)boranuide;bis(3-methyl-2H-imidazol-2-ylium-1-yl)-bis(4-methylphenyl)boranuide;bis(bis(3-methyl-2H-imidazol-2-ylium-1-yl)-diphenylboranuide);bis(bis(3-methyl-2H-imidazol-2-ylium-1-yl)-di(pyrazol-1-yl)boranuide);bis(diethyl-bis(3-methyl-2H-imidazol-2-ylium-1-yl)boranuide);hexakis(2-(2,4-difluorobenzene-6-id-1-yl)pyridine);hexakis(iridium);tetrakis(2-phenylpyridine);platinum
CID 158245416
CID 161627694
CID 161627694
chloroplatinum(1+);4-methyl-2,6-bis(2H-pyrrol-2-id-1-ylmethyl)pyridine;1-[[3-methyl-5-(pyrazol-1-ylmethyl)benzene-6-id-1-yl]methyl]pyrazole;1-[[3-methyl-5-(1,2,4-triazol-1-ylmethyl)benzene-6-id-1-yl]methyl]-1,2,4-triazole;2-[[3-methyl-5-(triazol-2-ylmethyl)benzene-6-id-1-yl]methyl]triazole;phenol;4-phenyl-2-(pyrazol-1-ylmethyl)-6-(2H-pyrrol-2-id-1-ylmethyl)pyridine;4-phenyl-2-(2H-pyrrol-2-id-1-ylmethyl)-6-(triazol-2-ylmethyl)pyridine;platinum;platinum(2+);2-(1-pyrazol-1-ylcyclohexyl)-6-[1-(2H-pyrrol-2-id-1-yl)cyclohexyl]pyridine;1-[[3-(pyrazol-1-ylmethyl)benzene-2-id-1-yl]methyl]pyrazole;pyridine
CID 157086738
5-[2-(2-Fluoro-6-methoxyphenyl)ethyl]-8-imidazol-1-yl-[1,2,4]triazolo[4,3-a]pyridine;5-[2-(2-fluoro-6-methoxyphenyl)ethyl]-8-(2-methylimidazol-1-yl)-[1,2,4]triazolo[4,3-a]pyridine;5-[2-(2-fluoro-6-methoxyphenyl)ethyl]-8-(3-methylpyrazol-1-yl)-[1,2,4]triazolo[4,3-a]pyridine;5-[2-(2-fluoro-6-methoxyphenyl)ethyl]-8-(triazol-1-yl)-[1,2,4]triazolo[4,3-a]pyridine;5-[2-(2-fluoro-6-methoxyphenyl)ethyl]-8-(1,2,4-triazol-1-yl)-[1,2,4]triazolo[4,3-a]pyridine;5-[2-(2-methoxyphenyl)ethyl]-8-(2-methyl-3-pyridinyl)-[1,2,4]triazolo[4,3-a]pyridine;5-[2-(6-methoxy-2-pyridinyl)ethyl]-8-(2-methyl-3-pyridinyl)-[1,2,4]triazolo[4,3-a]pyridine
CID 157605612

Frequently Asked Questions

What is the IUPAC name of bis[3,5-bis(trifluoromethyl)phenyl]-(3-methyl-2H-imidazol-2-ylium-1-yl)-pyrazol-1-ylboranuide;bis(4-fluorophenyl)-bis(3-methyl-2H-imidazol-2-ylium-1-yl)boranuide;bis(4-fluorophenyl)-(3-methyl-2H-imidazol-2-ylium-1-yl)-pyrazol-1-ylboranuide;bis(3-methyl-2H-imidazol-2-ylium-1-yl)-bis(4-methylphenyl)boranuide;diethyl-(3-methyl-2H-imidazol-2-ylium-1-yl)-pyrazol-1-ylboranuide;decakis(iridium);(3-methyl-2H-imidazol-2-ylium-1-yl)-bis(4-methylphenyl)-pyrazol-1-ylboranuide;(3-methyl-2H-imidazol-2-ylium-1-yl)-diphenyl-pyrazol-1-ylboranuide;(3-methyl-2H-imidazol-2-ylium-1-yl)-tri(pyrazol-1-yl)boranuide;1-methyl-3-[8-(3-methyl-2H-imidazol-2-ylium-1-yl)-8-boranuidatricyclo[7.4.0.02,7]trideca-1(13),2,4,6,9,11-hexaen-8-yl]-2H-imidazol-2-ylium;1-methyl-3-[8-(3-methyl-2H-imidazol-2-ylium-1-yl)-7,9-dioxa-8-boranuidabicyclo[4.3.0]nona-1,3,5-trien-8-yl]-2H-imidazol-2-ylium;decakis(2-phenylpyridine)?
The IUPAC name of bis[3,5-bis(trifluoromethyl)phenyl]-(3-methyl-2H-imidazol-2-ylium-1-yl)-pyrazol-1-ylboranuide;bis(4-fluorophenyl)-bis(3-methyl-2H-imidazol-2-ylium-1-yl)boranuide;bis(4-fluorophenyl)-(3-methyl-2H-imidazol-2-ylium-1-yl)-pyrazol-1-ylboranuide;bis(3-methyl-2H-imidazol-2-ylium-1-yl)-bis(4-methylphenyl)boranuide;diethyl-(3-methyl-2H-imidazol-2-ylium-1-yl)-pyrazol-1-ylboranuide;decakis(iridium);(3-methyl-2H-imidazol-2-ylium-1-yl)-bis(4-methylphenyl)-pyrazol-1-ylboranuide;(3-methyl-2H-imidazol-2-ylium-1-yl)-diphenyl-pyrazol-1-ylboranuide;(3-methyl-2H-imidazol-2-ylium-1-yl)-tri(pyrazol-1-yl)boranuide;1-methyl-3-[8-(3-methyl-2H-imidazol-2-ylium-1-yl)-8-boranuidatricyclo[7.4.0.02,7]trideca-1(13),2,4,6,9,11-hexaen-8-yl]-2H-imidazol-2-ylium;1-methyl-3-[8-(3-methyl-2H-imidazol-2-ylium-1-yl)-7,9-dioxa-8-boranuidabicyclo[4.3.0]nona-1,3,5-trien-8-yl]-2H-imidazol-2-ylium;decakis(2-phenylpyridine) (CID 158252794) is bis[3,5-bis(trifluoromethyl)phenyl]-(3-methyl-2H-imidazol-2-ylium-1-yl)-pyrazol-1-ylboranuide;bis(4-fluorophenyl)-bis(3-methyl-2H-imidazol-2-ylium-1-yl)boranuide;bis(4-fluorophenyl)-(3-methyl-2H-imidazol-2-ylium-1-yl)-pyrazol-1-ylboranuide;bis(3-methyl-2H-imidazol-2-ylium-1-yl)-bis(4-methylphenyl)boranuide;diethyl-(3-methyl-2H-imidazol-2-ylium-1-yl)-pyrazol-1-ylboranuide;decakis(iridium);(3-methyl-2H-imidazol-2-ylium-1-yl)-bis(4-methylphenyl)-pyrazol-1-ylboranuide;(3-methyl-2H-imidazol-2-ylium-1-yl)-diphenyl-pyrazol-1-ylboranuide;(3-methyl-2H-imidazol-2-ylium-1-yl)-tri(pyrazol-1-yl)boranuide;1-methyl-3-[8-(3-methyl-2H-imidazol-2-ylium-1-yl)-8-boranuidatricyclo[7.4.0.02,7]trideca-1(13),2,4,6,9,11-hexaen-8-yl]-2H-imidazol-2-ylium;1-methyl-3-[8-(3-methyl-2H-imidazol-2-ylium-1-yl)-7,9-dioxa-8-boranuidabicyclo[4.3.0]nona-1,3,5-trien-8-yl]-2H-imidazol-2-ylium;decakis(2-phenylpyridine).
What is the SMILES notation for bis[3,5-bis(trifluoromethyl)phenyl]-(3-methyl-2H-imidazol-2-ylium-1-yl)-pyrazol-1-ylboranuide;bis(4-fluorophenyl)-bis(3-methyl-2H-imidazol-2-ylium-1-yl)boranuide;bis(4-fluorophenyl)-(3-methyl-2H-imidazol-2-ylium-1-yl)-pyrazol-1-ylboranuide;bis(3-methyl-2H-imidazol-2-ylium-1-yl)-bis(4-methylphenyl)boranuide;diethyl-(3-methyl-2H-imidazol-2-ylium-1-yl)-pyrazol-1-ylboranuide;decakis(iridium);(3-methyl-2H-imidazol-2-ylium-1-yl)-bis(4-methylphenyl)-pyrazol-1-ylboranuide;(3-methyl-2H-imidazol-2-ylium-1-yl)-diphenyl-pyrazol-1-ylboranuide;(3-methyl-2H-imidazol-2-ylium-1-yl)-tri(pyrazol-1-yl)boranuide;1-methyl-3-[8-(3-methyl-2H-imidazol-2-ylium-1-yl)-8-boranuidatricyclo[7.4.0.02,7]trideca-1(13),2,4,6,9,11-hexaen-8-yl]-2H-imidazol-2-ylium;1-methyl-3-[8-(3-methyl-2H-imidazol-2-ylium-1-yl)-7,9-dioxa-8-boranuidabicyclo[4.3.0]nona-1,3,5-trien-8-yl]-2H-imidazol-2-ylium;decakis(2-phenylpyridine)?
The canonical SMILES for bis[3,5-bis(trifluoromethyl)phenyl]-(3-methyl-2H-imidazol-2-ylium-1-yl)-pyrazol-1-ylboranuide;bis(4-fluorophenyl)-bis(3-methyl-2H-imidazol-2-ylium-1-yl)boranuide;bis(4-fluorophenyl)-(3-methyl-2H-imidazol-2-ylium-1-yl)-pyrazol-1-ylboranuide;bis(3-methyl-2H-imidazol-2-ylium-1-yl)-bis(4-methylphenyl)boranuide;diethyl-(3-methyl-2H-imidazol-2-ylium-1-yl)-pyrazol-1-ylboranuide;decakis(iridium);(3-methyl-2H-imidazol-2-ylium-1-yl)-bis(4-methylphenyl)-pyrazol-1-ylboranuide;(3-methyl-2H-imidazol-2-ylium-1-yl)-diphenyl-pyrazol-1-ylboranuide;(3-methyl-2H-imidazol-2-ylium-1-yl)-tri(pyrazol-1-yl)boranuide;1-methyl-3-[8-(3-methyl-2H-imidazol-2-ylium-1-yl)-8-boranuidatricyclo[7.4.0.02,7]trideca-1(13),2,4,6,9,11-hexaen-8-yl]-2H-imidazol-2-ylium;1-methyl-3-[8-(3-methyl-2H-imidazol-2-ylium-1-yl)-7,9-dioxa-8-boranuidabicyclo[4.3.0]nona-1,3,5-trien-8-yl]-2H-imidazol-2-ylium;decakis(2-phenylpyridine) is CC[B-](CC)(n1ccn(C)[cH+]1)n1cccn1.Cc1ccc([B-](c2ccc(C)cc2)(n2ccn(C)[cH+]2)n2cccn2)cc1.Cc1ccc([B-](c2ccc(C)cc2)(n2ccn(C)[cH+]2)n2ccn(C)[cH+]2)cc1.Cn1ccn([B-](c2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2cc(C(F)(F)F)cc(C(F)(F)F)c2)n2cccn2)[cH+]1.Cn1ccn([B-](c2ccc(F)cc2)(c2ccc(F)cc2)n2cccn2)[cH+]1.Cn1ccn([B-](c2ccc(F)cc2)(c2ccc(F)cc2)n2ccn(C)[cH+]2)[cH+]1.Cn1ccn([B-](c2ccccc2)(c2ccccc2)n2cccn2)[cH+]1.Cn1ccn([B-](n2cccn2)(n2cccn2)n2cccn2)[cH+]1.Cn1ccn([B-]2(n3ccn(C)[cH+]3)Oc3ccccc3O2)[cH+]1.Cn1ccn([B-]2(n3ccn(C)[cH+]3)c3ccccc3-c3ccccc32)[cH+]1.[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.[c-]1ccccc1-c1ccccn1.
What is the InChIKey of bis[3,5-bis(trifluoromethyl)phenyl]-(3-methyl-2H-imidazol-2-ylium-1-yl)-pyrazol-1-ylboranuide;bis(4-fluorophenyl)-bis(3-methyl-2H-imidazol-2-ylium-1-yl)boranuide;bis(4-fluorophenyl)-(3-methyl-2H-imidazol-2-ylium-1-yl)-pyrazol-1-ylboranuide;bis(3-methyl-2H-imidazol-2-ylium-1-yl)-bis(4-methylphenyl)boranuide;diethyl-(3-methyl-2H-imidazol-2-ylium-1-yl)-pyrazol-1-ylboranuide;decakis(iridium);(3-methyl-2H-imidazol-2-ylium-1-yl)-bis(4-methylphenyl)-pyrazol-1-ylboranuide;(3-methyl-2H-imidazol-2-ylium-1-yl)-diphenyl-pyrazol-1-ylboranuide;(3-methyl-2H-imidazol-2-ylium-1-yl)-tri(pyrazol-1-yl)boranuide;1-methyl-3-[8-(3-methyl-2H-imidazol-2-ylium-1-yl)-8-boranuidatricyclo[7.4.0.02,7]trideca-1(13),2,4,6,9,11-hexaen-8-yl]-2H-imidazol-2-ylium;1-methyl-3-[8-(3-methyl-2H-imidazol-2-ylium-1-yl)-7,9-dioxa-8-boranuidabicyclo[4.3.0]nona-1,3,5-trien-8-yl]-2H-imidazol-2-ylium;decakis(2-phenylpyridine)?
The InChIKey is JVZCTHMKHVYNRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H15BF12N4.C22H26BN4.C21H23BN4.C20H20BF2N4.C20H20BN4.C19H17BF2N4.C19H19BN4.C14H16BN4O2.C13H15BN8.C11H19BN4.10C11H8N.10Ir/c1-38-5-6-39(13-38)24(40-4-2-3-37-40,18-9-14(20(25,26)27)7-15(10-18)21(28,29)30)19-11-16(22(31,32)33)8-17(12-19)23(34,35)36;1-19-5-9-21(10-6-19)23(26-15-13-24(3)17-26,27-16-14-25(4)18-27)22-11-7-20(2)8-12-22;1-18-5-9-20(10-6-18)22(26-14-4-13-23-26,25-16-15-24(3)17-25)21-11-7-19(2)8-12-21;1-24-11-13-26(15-24)21(27-14-12-25(2)16-27,17-3-7-19(22)8-4-17)18-5-9-20(23)10-6-18;1-22-11-13-24(15-22)21(25-14-12-23(2)16-25)19-9-5-3-7-17(19)18-8-4-6-10-20(18)21;1-24-13-14-25(15-24)20(26-12-2-11-23-26,16-3-7-18(21)8-4-16)17-5-9-19(22)10-6-17;1-22-15-16-23(17-22)20(24-14-8-13-21-24,18-9-4-2-5-10-18)19-11-6-3-7-12-19;1-16-7-9-18(11-16)15(19-10-8-17(2)12-19)20-13-5-3-4-6-14(13)21-15;1-18-11-12-19(13-18)14(20-8-2-5-15-20,21-9-3-6-16-21)22-10-4-7-17-22;1-4-12(5-2,16-8-6-7-13-16)15-10-9-14(3)11-15;10*1-2-6-10(7-3-1)11-8-4-5-9-12-11;;;;;;;;;;/h2-13H,1H3;5-18H,1-4H3;4-17H,1-3H3;3-16H,1-2H3;3-16H,1-2H3;2-15H,1H3;2-17H,1H3;3-12H,1-2H3;2-13H,1H3;6-11H,4-5H2,1-3H3;10*1-6,8-9H;;;;;;;;;;/q;+1;;2*+1;;;+1;;;10*-1;;;;;;;;;;.
What are the key properties of bis[3,5-bis(trifluoromethyl)phenyl]-(3-methyl-2H-imidazol-2-ylium-1-yl)-pyrazol-1-ylboranuide;bis(4-fluorophenyl)-bis(3-methyl-2H-imidazol-2-ylium-1-yl)boranuide;bis(4-fluorophenyl)-(3-methyl-2H-imidazol-2-ylium-1-yl)-pyrazol-1-ylboranuide;bis(3-methyl-2H-imidazol-2-ylium-1-yl)-bis(4-methylphenyl)boranuide;diethyl-(3-methyl-2H-imidazol-2-ylium-1-yl)-pyrazol-1-ylboranuide;decakis(iridium);(3-methyl-2H-imidazol-2-ylium-1-yl)-bis(4-methylphenyl)-pyrazol-1-ylboranuide;(3-methyl-2H-imidazol-2-ylium-1-yl)-diphenyl-pyrazol-1-ylboranuide;(3-methyl-2H-imidazol-2-ylium-1-yl)-tri(pyrazol-1-yl)boranuide;1-methyl-3-[8-(3-methyl-2H-imidazol-2-ylium-1-yl)-8-boranuidatricyclo[7.4.0.02,7]trideca-1(13),2,4,6,9,11-hexaen-8-yl]-2H-imidazol-2-ylium;1-methyl-3-[8-(3-methyl-2H-imidazol-2-ylium-1-yl)-7,9-dioxa-8-boranuidabicyclo[4.3.0]nona-1,3,5-trien-8-yl]-2H-imidazol-2-ylium;decakis(2-phenylpyridine)?
bis[3,5-bis(trifluoromethyl)phenyl]-(3-methyl-2H-imidazol-2-ylium-1-yl)-pyrazol-1-ylboranuide;bis(4-fluorophenyl)-bis(3-methyl-2H-imidazol-2-ylium-1-yl)boranuide;bis(4-fluorophenyl)-(3-methyl-2H-imidazol-2-ylium-1-yl)-pyrazol-1-ylboranuide;bis(3-methyl-2H-imidazol-2-ylium-1-yl)-bis(4-methylphenyl)boranuide;diethyl-(3-methyl-2H-imidazol-2-ylium-1-yl)-pyrazol-1-ylboranuide;decakis(iridium);(3-methyl-2H-imidazol-2-ylium-1-yl)-bis(4-methylphenyl)-pyrazol-1-ylboranuide;(3-methyl-2H-imidazol-2-ylium-1-yl)-diphenyl-pyrazol-1-ylboranuide;(3-methyl-2H-imidazol-2-ylium-1-yl)-tri(pyrazol-1-yl)boranuide;1-methyl-3-[8-(3-methyl-2H-imidazol-2-ylium-1-yl)-8-boranuidatricyclo[7.4.0.02,7]trideca-1(13),2,4,6,9,11-hexaen-8-yl]-2H-imidazol-2-ylium;1-methyl-3-[8-(3-methyl-2H-imidazol-2-ylium-1-yl)-7,9-dioxa-8-boranuidabicyclo[4.3.0]nona-1,3,5-trien-8-yl]-2H-imidazol-2-ylium;decakis(2-phenylpyridine) has a molecular weight of 6902.01 g/mol, XLogP of 50.32, 46 rotatable bonds, 0 hydrogen bond donors, and 56 hydrogen bond acceptors.
Where does this data come from?
All data for bis[3,5-bis(trifluoromethyl)phenyl]-(3-methyl-2H-imidazol-2-ylium-1-yl)-pyrazol-1-ylboranuide;bis(4-fluorophenyl)-bis(3-methyl-2H-imidazol-2-ylium-1-yl)boranuide;bis(4-fluorophenyl)-(3-methyl-2H-imidazol-2-ylium-1-yl)-pyrazol-1-ylboranuide;bis(3-methyl-2H-imidazol-2-ylium-1-yl)-bis(4-methylphenyl)boranuide;diethyl-(3-methyl-2H-imidazol-2-ylium-1-yl)-pyrazol-1-ylboranuide;decakis(iridium);(3-methyl-2H-imidazol-2-ylium-1-yl)-bis(4-methylphenyl)-pyrazol-1-ylboranuide;(3-methyl-2H-imidazol-2-ylium-1-yl)-diphenyl-pyrazol-1-ylboranuide;(3-methyl-2H-imidazol-2-ylium-1-yl)-tri(pyrazol-1-yl)boranuide;1-methyl-3-[8-(3-methyl-2H-imidazol-2-ylium-1-yl)-8-boranuidatricyclo[7.4.0.02,7]trideca-1(13),2,4,6,9,11-hexaen-8-yl]-2H-imidazol-2-ylium;1-methyl-3-[8-(3-methyl-2H-imidazol-2-ylium-1-yl)-7,9-dioxa-8-boranuidabicyclo[4.3.0]nona-1,3,5-trien-8-yl]-2H-imidazol-2-ylium;decakis(2-phenylpyridine) is sourced from PubChem (CID 158252794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).