4-tert-butyl-2-[2-[3-[2-[5-tert-butyl-3-(2,7-ditert-butylcarbazol-9-yl)-2-hydroxyphenyl]-4-fluoro-6-methylphenoxy]propoxy]-5-fluorophenyl]-6-(2,7-ditert-butylcarbazol-9-yl)phenol;2-[4-tert-butyl-2-[3-[2-[3-(2,7-ditert-butylcarbazol-9-yl)-2-hydroxy-5-(2,4,4-trimethylpentan-2-yl)phenyl]-4-fluoro-6-methylphenoxy]propoxy]-5-fluorophenyl]-6-(2,7-ditert-butylcarbazol-9-yl)-4-(2,4,4-trimethylpentan-2-yl)phenol;2-[2-[[(1R,2R)-2-[[2-[3-(7-tert-butyl-1,2,5-trimethylcarbazol-9-yl)-2-hydroxy-5-(2,4,4-trimethylpentan-2-yl)phenyl]-4-fluoro-6-methylphenoxy]methyl]cyclohexyl]methoxy]-5-fluoro-3-methylphenyl]-6-(2,7-ditert-butylcarbazol-9-yl)-4-(2,4,4-trimethylpentan-2-yl)phenol;carbanide;2-(2,7-ditert-butylcarbazol-9-yl)-6-[2-[3-[2-[3-(2,7-ditert-butylcarbazol-9-yl)-5-ethyl-2-hydroxyphenyl]-4,6-dimethylphenoxy]propoxy]-3,5-dimethylphenyl]-4-ethylphenol;hafnium

C336H416F6Hf4N8O16-8 — CID 158852535

IUPAC4-tert-butyl-2-[2-[3-[2-[5-tert-butyl-3-(2,7-ditert-butylcarbazol-9-yl)-2-hydroxyphenyl]-4-fluoro-6-methylphenoxy]propoxy]-5-fluorophenyl]-6-(2,7-ditert-butylcarbazol-9-yl)phenol;2-[4-tert-butyl-2-[3-[2-[3-(2,7-ditert-butylcarbazol-9-yl)-2-hydroxy-5-(2,4,4-trimethylpentan-2-yl)phenyl]-4-fluoro-6-methylphenoxy]propoxy]-5-fluorophenyl]-6-(2,7-ditert-butylcarbazol-9-yl)-4-(2,4,4-trimethylpentan-2-yl)phenol;2-[2-[[(1R,2R)-2-[[2-[3-(7-tert-butyl-1,2,5-trimethylcarbazol-9-yl)-2-hydroxy-5-(2,4,4-trimethylpentan-2-yl)phenyl]-4-fluoro-6-methylphenoxy]methyl]cyclohexyl]methoxy]-5-fluoro-3-methylphenyl]-6-(2,7-ditert-butylcarbazol-9-yl)-4-(2,4,4-trimethylpentan-2-yl)phenol;carbanide;2-(2,7-ditert-butylcarbazol-9-yl)-6-[2-[3-[2-[3-(2,7-ditert-butylcarbazol-9-yl)-5-ethyl-2-hydroxyphenyl]-4,6-dimethylphenoxy]propoxy]-3,5-dimethylphenyl]-4-ethylphenol;hafnium
SMILESCCc1cc(-c2cc(C)cc(C)c2OCCCOc2c(C)cc(C)cc2-c2cc(CC)cc(-n3c4cc(C(C)(C)C)ccc4c4ccc(C(C)(C)C)cc43)c2O)c(O)c(-n2c3cc(C(C)(C)C)ccc3c3ccc(C(C)(C)C)cc32)c1.Cc1cc(F)cc(-c2cc(C(C)(C)C)cc(-n3c4cc(C(C)(C)C)ccc4c4ccc(C(C)(C)C)cc43)c2O)c1OCCCOc1ccc(F)cc1-c1cc(C(C)(C)C)cc(-n2c3cc(C(C)(C)C)ccc3c3ccc(C(C)(C)C)cc32)c1O.Cc1cc(F)cc(-c2cc(C(C)(C)CC(C)(C)C)cc(-n3c4cc(C(C)(C)C)ccc4c4ccc(C(C)(C)C)cc43)c2O)c1OCCCOc1cc(C(C)(C)C)c(F)cc1-c1cc(C(C)(C)CC(C)(C)C)cc(-n2c3cc(C(C)(C)C)ccc3c3ccc(C(C)(C)C)cc32)c1O.Cc1cc(F)cc(-c2cc(C(C)(C)CC(C)(C)C)cc(-n3c4cc(C(C)(C)C)ccc4c4ccc(C(C)(C)C)cc43)c2O)c1OC[C@@H]1CCCC[C@H]1COc1c(C)cc(F)cc1-c1cc(C(C)(C)CC(C)(C)C)cc(-n2c3cc(C(C)(C)C)cc(C)c3c3ccc(C)c(C)c32)c1O.[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[Hf].[Hf].[Hf].[Hf]
InChIInChI=1S/C89H110F2N2O4.C88H110F2N2O4.C76H86F2N2O4.C75H86N2O4.8CH3.4Hf/c1-51-29-32-67-77-52(2)35-60(87(18,19)20)42-74(77)93(78(67)55(51)5)76-44-62(89(23,24)50-84(9,10)11)39-69(80(76)95)71-46-64(91)37-54(4)82(71)97-48-57-28-26-25-27-56(57)47-96-81-53(3)36-63(90)45-70(81)68-38-61(88(21,22)49-83(6,7)8)43-75(79(68)94)92-72-40-58(85(12,13)14)30-33-65(72)66-34-31-59(41-73(66)92)86(15,16)17;1-52-38-59(89)47-67(66-40-58(88(25,26)51-81(5,6)7)46-75(78(66)94)92-72-43-55(84(14,15)16)30-34-62(72)63-35-31-56(44-73(63)92)85(17,18)19)79(52)96-37-27-36-95-76-49-68(86(20,21)22)69(90)48-64(76)65-39-57(87(23,24)50-80(2,3)4)45-74(77(65)93)91-70-41-53(82(8,9)10)28-32-60(70)61-33-29-54(42-71(61)91)83(11,12)13;1-44-33-52(78)43-60(59-35-50(76(17,18)19)41-66(69(59)82)80-63-38-47(73(8,9)10)23-28-55(63)56-29-24-48(39-64(56)80)74(11,12)13)70(44)84-32-20-31-83-67-30-25-51(77)42-57(67)58-34-49(75(14,15)16)40-65(68(58)81)79-61-36-45(71(2,3)4)21-26-53(61)54-27-22-46(37-62(54)79)72(5,6)7;1-19-48-36-58(68(78)66(38-48)76-62-40-50(72(7,8)9)22-26-54(62)55-27-23-51(41-63(55)76)73(10,11)12)60-34-44(3)32-46(5)70(60)80-30-21-31-81-71-47(6)33-45(4)35-61(71)59-37-49(20-2)39-67(69(59)79)77-64-42-52(74(13,14)15)24-28-56(64)57-29-25-53(43-65(57)77)75(16,17)18;;;;;;;;;;;;/h29-46,56-57,94-95H,25-28,47-50H2,1-24H3;28-35,38-49,93-94H,27,36-37,50-51H2,1-26H3;21-30,33-43,81-82H,20,31-32H2,1-19H3;22-29,32-43,78-79H,19-21,30-31H2,1-18H3;8*1H3;;;;/q;;;;8*-1;;;;/t56-,57-;;;;;;;;;;;;;;;/m0.............../s1
InChIKeyNXTDJLBNKGYIKP-LETPZUJCSA-N
MW5651.01 g/mol
LogP94.47
Rot. Bonds50

About 4-tert-butyl-2-[2-[3-[2-[5-tert-butyl-3-(2,7-ditert-butylcarbazol-9-yl)-2-hydroxyphenyl]-4-fluoro-6-methylphenoxy]propoxy]-5-fluorophenyl]-6-(2,7-ditert-butylcarbazol-9-yl)phenol;2-[4-tert-butyl-2-[3-[2-[3-(2,7-ditert-butylcarbazol-9-yl)-2-hydroxy-5-(2,4,4-trimethylpentan-2-yl)phenyl]-4-fluoro-6-methylphenoxy]propoxy]-5-fluorophenyl]-6-(2,7-ditert-butylcarbazol-9-yl)-4-(2,4,4-trimethylpentan-2-yl)phenol;2-[2-[[(1R,2R)-2-[[2-[3-(7-tert-butyl-1,2,5-trimethylcarbazol-9-yl)-2-hydroxy-5-(2,4,4-trimethylpentan-2-yl)phenyl]-4-fluoro-6-methylphenoxy]methyl]cyclohexyl]methoxy]-5-fluoro-3-methylphenyl]-6-(2,7-ditert-butylcarbazol-9-yl)-4-(2,4,4-trimethylpentan-2-yl)phenol;carbanide;2-(2,7-ditert-butylcarbazol-9-yl)-6-[2-[3-[2-[3-(2,7-ditert-butylcarbazol-9-yl)-5-ethyl-2-hydroxyphenyl]-4,6-dimethylphenoxy]propoxy]-3,5-dimethylphenyl]-4-ethylphenol;hafnium

4-tert-butyl-2-[2-[3-[2-[5-tert-butyl-3-(2,7-ditert-butylcarbazol-9-yl)-2-hydroxyphenyl]-4-fluoro-6-methylphenoxy]propoxy]-5-fluorophenyl]-6-(2,7-ditert-butylcarbazol-9-yl)phenol;2-[4-tert-butyl-2-[3-[2-[3-(2,7-ditert-butylcarbazol-9-yl)-2-hydroxy-5-(2,4,4-trimethylpentan-2-yl)phenyl]-4-fluoro-6-methylphenoxy]propoxy]-5-fluorophenyl]-6-(2,7-ditert-butylcarbazol-9-yl)-4-(2,4,4-trimethylpentan-2-yl)phenol;2-[2-[[(1R,2R)-2-[[2-[3-(7-tert-butyl-1,2,5-trimethylcarbazol-9-yl)-2-hydroxy-5-(2,4,4-trimethylpentan-2-yl)phenyl]-4-fluoro-6-methylphenoxy]methyl]cyclohexyl]methoxy]-5-fluoro-3-methylphenyl]-6-(2,7-ditert-butylcarbazol-9-yl)-4-(2,4,4-trimethylpentan-2-yl)phenol;carbanide;2-(2,7-ditert-butylcarbazol-9-yl)-6-[2-[3-[2-[3-(2,7-ditert-butylcarbazol-9-yl)-5-ethyl-2-hydroxyphenyl]-4,6-dimethylphenoxy]propoxy]-3,5-dimethylphenyl]-4-ethylphenol;hafnium (PubChem CID 158852535) has the molecular formula C336H416F6Hf4N8O16-8 and a molecular weight of 5651.01 g/mol. Its IUPAC name is 4-tert-butyl-2-[2-[3-[2-[5-tert-butyl-3-(2,7-ditert-butylcarbazol-9-yl)-2-hydroxyphenyl]-4-fluoro-6-methylphenoxy]propoxy]-5-fluorophenyl]-6-(2,7-ditert-butylcarbazol-9-yl)phenol;2-[4-tert-butyl-2-[3-[2-[3-(2,7-ditert-butylcarbazol-9-yl)-2-hydroxy-5-(2,4,4-trimethylpentan-2-yl)phenyl]-4-fluoro-6-methylphenoxy]propoxy]-5-fluorophenyl]-6-(2,7-ditert-butylcarbazol-9-yl)-4-(2,4,4-trimethylpentan-2-yl)phenol;2-[2-[[(1R,2R)-2-[[2-[3-(7-tert-butyl-1,2,5-trimethylcarbazol-9-yl)-2-hydroxy-5-(2,4,4-trimethylpentan-2-yl)phenyl]-4-fluoro-6-methylphenoxy]methyl]cyclohexyl]methoxy]-5-fluoro-3-methylphenyl]-6-(2,7-ditert-butylcarbazol-9-yl)-4-(2,4,4-trimethylpentan-2-yl)phenol;carbanide;2-(2,7-ditert-butylcarbazol-9-yl)-6-[2-[3-[2-[3-(2,7-ditert-butylcarbazol-9-yl)-5-ethyl-2-hydroxyphenyl]-4,6-dimethylphenoxy]propoxy]-3,5-dimethylphenyl]-4-ethylphenol;hafnium.

Molecular Properties

Compound Name4-tert-butyl-2-[2-[3-[2-[5-tert-butyl-3-(2,7-ditert-butylcarbazol-9-yl)-2-hydroxyphenyl]-4-fluoro-6-methylphenoxy]propoxy]-5-fluorophenyl]-6-(2,7-ditert-butylcarbazol-9-yl)phenol;2-[4-tert-butyl-2-[3-[2-[3-(2,7-ditert-butylcarbazol-9-yl)-2-hydroxy-5-(2,4,4-trimethylpentan-2-yl)phenyl]-4-fluoro-6-methylphenoxy]propoxy]-5-fluorophenyl]-6-(2,7-ditert-butylcarbazol-9-yl)-4-(2,4,4-trimethylpentan-2-yl)phenol;2-[2-[[(1R,2R)-2-[[2-[3-(7-tert-butyl-1,2,5-trimethylcarbazol-9-yl)-2-hydroxy-5-(2,4,4-trimethylpentan-2-yl)phenyl]-4-fluoro-6-methylphenoxy]methyl]cyclohexyl]methoxy]-5-fluoro-3-methylphenyl]-6-(2,7-ditert-butylcarbazol-9-yl)-4-(2,4,4-trimethylpentan-2-yl)phenol;carbanide;2-(2,7-ditert-butylcarbazol-9-yl)-6-[2-[3-[2-[3-(2,7-ditert-butylcarbazol-9-yl)-5-ethyl-2-hydroxyphenyl]-4,6-dimethylphenoxy]propoxy]-3,5-dimethylphenyl]-4-ethylphenol;hafnium
PubChem CID158852535
Molecular FormulaC336H416F6Hf4N8O16-8
Molecular Weight5651.01 g/mol
Exact Mass5652.98
IUPAC Name4-tert-butyl-2-[2-[3-[2-[5-tert-butyl-3-(2,7-ditert-butylcarbazol-9-yl)-2-hydroxyphenyl]-4-fluoro-6-methylphenoxy]propoxy]-5-fluorophenyl]-6-(2,7-ditert-butylcarbazol-9-yl)phenol;2-[4-tert-butyl-2-[3-[2-[3-(2,7-ditert-butylcarbazol-9-yl)-2-hydroxy-5-(2,4,4-trimethylpentan-2-yl)phenyl]-4-fluoro-6-methylphenoxy]propoxy]-5-fluorophenyl]-6-(2,7-ditert-butylcarbazol-9-yl)-4-(2,4,4-trimethylpentan-2-yl)phenol;2-[2-[[(1R,2R)-2-[[2-[3-(7-tert-butyl-1,2,5-trimethylcarbazol-9-yl)-2-hydroxy-5-(2,4,4-trimethylpentan-2-yl)phenyl]-4-fluoro-6-methylphenoxy]methyl]cyclohexyl]methoxy]-5-fluoro-3-methylphenyl]-6-(2,7-ditert-butylcarbazol-9-yl)-4-(2,4,4-trimethylpentan-2-yl)phenol;carbanide;2-(2,7-ditert-butylcarbazol-9-yl)-6-[2-[3-[2-[3-(2,7-ditert-butylcarbazol-9-yl)-5-ethyl-2-hydroxyphenyl]-4,6-dimethylphenoxy]propoxy]-3,5-dimethylphenyl]-4-ethylphenol;hafnium
SMILESCCc1cc(-c2cc(C)cc(C)c2OCCCOc2c(C)cc(C)cc2-c2cc(CC)cc(-n3c4cc(C(C)(C)C)ccc4c4ccc(C(C)(C)C)cc43)c2O)c(O)c(-n2c3cc(C(C)(C)C)ccc3c3ccc(C(C)(C)C)cc32)c1.Cc1cc(F)cc(-c2cc(C(C)(C)C)cc(-n3c4cc(C(C)(C)C)ccc4c4ccc(C(C)(C)C)cc43)c2O)c1OCCCOc1ccc(F)cc1-c1cc(C(C)(C)C)cc(-n2c3cc(C(C)(C)C)ccc3c3ccc(C(C)(C)C)cc32)c1O.Cc1cc(F)cc(-c2cc(C(C)(C)CC(C)(C)C)cc(-n3c4cc(C(C)(C)C)ccc4c4ccc(C(C)(C)C)cc43)c2O)c1OCCCOc1cc(C(C)(C)C)c(F)cc1-c1cc(C(C)(C)CC(C)(C)C)cc(-n2c3cc(C(C)(C)C)ccc3c3ccc(C(C)(C)C)cc32)c1O.Cc1cc(F)cc(-c2cc(C(C)(C)CC(C)(C)C)cc(-n3c4cc(C(C)(C)C)ccc4c4ccc(C(C)(C)C)cc43)c2O)c1OC[C@@H]1CCCC[C@H]1COc1c(C)cc(F)cc1-c1cc(C(C)(C)CC(C)(C)C)cc(-n2c3cc(C(C)(C)C)cc(C)c3c3ccc(C)c(C)c32)c1O.[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[Hf].[Hf].[Hf].[Hf]
InChIInChI=1S/C89H110F2N2O4.C88H110F2N2O4.C76H86F2N2O4.C75H86N2O4.8CH3.4Hf/c1-51-29-32-67-77-52(2)35-60(87(18,19)20)42-74(77)93(78(67)55(51)5)76-44-62(89(23,24)50-84(9,10)11)39-69(80(76)95)71-46-64(91)37-54(4)82(71)97-48-57-28-26-25-27-56(57)47-96-81-53(3)36-63(90)45-70(81)68-38-61(88(21,22)49-83(6,7)8)43-75(79(68)94)92-72-40-58(85(12,13)14)30-33-65(72)66-34-31-59(41-73(66)92)86(15,16)17;1-52-38-59(89)47-67(66-40-58(88(25,26)51-81(5,6)7)46-75(78(66)94)92-72-43-55(84(14,15)16)30-34-62(72)63-35-31-56(44-73(63)92)85(17,18)19)79(52)96-37-27-36-95-76-49-68(86(20,21)22)69(90)48-64(76)65-39-57(87(23,24)50-80(2,3)4)45-74(77(65)93)91-70-41-53(82(8,9)10)28-32-60(70)61-33-29-54(42-71(61)91)83(11,12)13;1-44-33-52(78)43-60(59-35-50(76(17,18)19)41-66(69(59)82)80-63-38-47(73(8,9)10)23-28-55(63)56-29-24-48(39-64(56)80)74(11,12)13)70(44)84-32-20-31-83-67-30-25-51(77)42-57(67)58-34-49(75(14,15)16)40-65(68(58)81)79-61-36-45(71(2,3)4)21-26-53(61)54-27-22-46(37-62(54)79)72(5,6)7;1-19-48-36-58(68(78)66(38-48)76-62-40-50(72(7,8)9)22-26-54(62)55-27-23-51(41-63(55)76)73(10,11)12)60-34-44(3)32-46(5)70(60)80-30-21-31-81-71-47(6)33-45(4)35-61(71)59-37-49(20-2)39-67(69(59)79)77-64-42-52(74(13,14)15)24-28-56(64)57-29-25-53(43-65(57)77)75(16,17)18;;;;;;;;;;;;/h29-46,56-57,94-95H,25-28,47-50H2,1-24H3;28-35,38-49,93-94H,27,36-37,50-51H2,1-26H3;21-30,33-43,81-82H,20,31-32H2,1-19H3;22-29,32-43,78-79H,19-21,30-31H2,1-18H3;8*1H3;;;;/q;;;;8*-1;;;;/t56-,57-;;;;;;;;;;;;;;;/m0.............../s1
InChIKeyNXTDJLBNKGYIKP-LETPZUJCSA-N
XLogP94.47
TPSA275.12 Ų
H-Bond Donors8
H-Bond Acceptors24
Rotatable Bonds50
Heavy Atoms370
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5005651.01
LogP ≤ 594.47
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1024

Analyze 4-tert-butyl-2-[2-[3-[2-[5-tert-butyl-3-(2,7-ditert-butylcarbazol-9-yl)-2-hydroxyphenyl]-4-fluoro-6-methylphenoxy]propoxy]-5-fluorophenyl]-6-(2,7-ditert-butylcarbazol-9-yl)phenol;2-[4-tert-butyl-2-[3-[2-[3-(2,7-ditert-butylcarbazol-9-yl)-2-hydroxy-5-(2,4,4-trimethylpentan-2-yl)phenyl]-4-fluoro-6-methylphenoxy]propoxy]-5-fluorophenyl]-6-(2,7-ditert-butylcarbazol-9-yl)-4-(2,4,4-trimethylpentan-2-yl)phenol;2-[2-[[(1R,2R)-2-[[2-[3-(7-tert-butyl-1,2,5-trimethylcarbazol-9-yl)-2-hydroxy-5-(2,4,4-trimethylpentan-2-yl)phenyl]-4-fluoro-6-methylphenoxy]methyl]cyclohexyl]methoxy]-5-fluoro-3-methylphenyl]-6-(2,7-ditert-butylcarbazol-9-yl)-4-(2,4,4-trimethylpentan-2-yl)phenol;carbanide;2-(2,7-ditert-butylcarbazol-9-yl)-6-[2-[3-[2-[3-(2,7-ditert-butylcarbazol-9-yl)-5-ethyl-2-hydroxyphenyl]-4,6-dimethylphenoxy]propoxy]-3,5-dimethylphenyl]-4-ethylphenol;hafnium with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[5-tert-butyl-2-[[(1S,2R)-2-[[4-tert-butyl-2-[3-(2,7-ditert-butylcarbazol-9-yl)-2-hydroxy-5-(2,4,4-trimethylpentan-2-yl)phenyl]phenoxy]methyl]cyclohexyl]methoxy]phenyl]-6-(2,7-ditert-butylcarbazol-9-yl)-4-(2,4,4-trimethylpentan-2-yl)phenol;carbanide;hafnium
CID 153303740
2-[5-tert-butyl-2-[3-[4-tert-butyl-2-[3-(3,5-ditert-butylphenyl)-2-hydroxy-5-methylphenyl]phenoxy]propoxy]phenyl]-6-(3,5-ditert-butylphenyl)-4-methylphenol;carbanide;2-carbazol-9-yl-6-[2-[[(1R,2R)-2-[[2-(3-carbazol-9-yl-2-hydroxy-5-methylphenyl)phenoxy]methyl]cyclohexyl]methoxy]phenyl]-4-methylphenol;2-(3,6-ditert-butylcarbazol-9-yl)-6-[2-[3-[2-[3-(3,6-ditert-butylcarbazol-9-yl)-2-hydroxy-5-(2,4,4-trimethylpentan-2-yl)phenyl]-4-fluorophenoxy]propoxy]-5-fluorophenyl]-4-(2,4,4-trimethylpentan-2-yl)phenol;hafnium;zirconium(2+)
CID 157086124
2-[5-tert-butyl-2-[[(1S,2R)-2-[[4-tert-butyl-2-[3-(2,7-ditert-butylcarbazol-9-yl)-2-hydroxy-5-(2,4,4-trimethylpentan-2-yl)phenyl]phenoxy]methyl]cyclohexyl]methoxy]phenyl]-6-(2,7-ditert-butylcarbazol-9-yl)-4-(2,4,4-trimethylpentan-2-yl)phenol
CID 153303741
2-[5-tert-butyl-2-[[(2S)-2-[[4-tert-butyl-2-[3-(2,7-ditert-butylcarbazol-9-yl)-2-hydroxy-5-(2,4,4-trimethylpentan-2-yl)phenyl]phenoxy]methyl]cyclohexyl]methoxy]phenyl]-6-(2,7-ditert-butylcarbazol-9-yl)-4-(2,4,4-trimethylpentan-2-yl)phenol
CID 153475221
2-(2,7-ditert-butylcarbazol-9-yl)-6-[2-[3-[2-[3-(2,7-ditert-butylcarbazol-9-yl)-2-hydroxy-5-(2,4,4-trimethylpentan-2-yl)phenyl]-4,6-difluorophenoxy]propoxy]-3,5-difluorophenyl]-4-(2,4,4-trimethylpentan-2-yl)phenol
CID 121290068
2-(2,7-dimethylcarbazol-9-yl)-6-[5-fluoro-3-methyl-2-[[(1R,2R)-2-methylcyclohexyl]methoxy]phenyl]-4-(2,4,4-trimethylpentan-2-yl)phenol
CID 140759572
carbanide;2-(2,7-ditert-butylcarbazol-9-yl)-6-[2-[3-[2-[3-(2,7-ditert-butylcarbazol-9-yl)-2-hydroxy-5-(2,4,4-trimethylpentan-2-yl)phenyl]-4,6-difluorophenoxy]propoxy]-5-fluorophenyl]-4-(2,4,4-trimethylpentan-2-yl)phenol;[2-[3-(2,7-ditert-butylcarbazol-9-yl)-2-hydroxy-5-(2,4,4-trimethylpentan-2-yl)phenyl]-4,6-difluorophenyl]-[3-[2-[3-(2,7-ditert-butylcarbazol-9-yl)-2-hydroxy-5-(2,4,4-trimethylpentan-2-yl)phenyl]-4-fluorophenyl]oxoniopropyl]oxidanium;hafnium
CID 162006008
2-(2,7-ditert-butylcarbazol-9-yl)-6-[2-[3-[2-[3-(2,7-ditert-butylcarbazol-9-yl)-2-hydroxy-5-(2,4,4-trimethylpentan-2-yl)phenyl]-4-fluoro-6-methylphenoxy]propoxy]-5-fluoro-3-methylphenyl]-4-(2,4-dimethylpentan-2-yl)phenol
CID 168744976
2-[5-tert-butyl-2-[[(2S)-2-[[4-tert-butyl-2-[3-(3,6-ditert-butylcarbazol-9-yl)-2-hydroxy-5-(2,4,4-trimethylpentan-2-yl)phenyl]phenoxy]methyl]cyclohexyl]methoxy]phenyl]-6-(3,6-ditert-butylcarbazol-9-yl)-4-(2,4,4-trimethylpentan-2-yl)phenol;carbanide;hafnium
CID 153475217
2-[2,7-bis(2,4,4-trimethylpentan-2-yl)carbazol-9-yl]-6-[2-[3-[2-[3-[2,7-bis(2,4,4-trimethylpentan-2-yl)carbazol-9-yl]-2-hydroxy-5-(2,4,4-trimethylpentan-2-yl)phenyl]-4-fluoro-6-methylphenoxy]propyl]-5-fluoro-3-methylphenyl]-4-(2,4,4-trimethylpentan-2-yl)phenol
CID 176653579
carbanide;2-(3,6-ditert-butylcarbazol-9-yl)-6-[2-[2-[2-[3-(3,6-ditert-butylcarbazol-9-yl)-2-hydroxy-5-(2,4,4-trimethylpentan-2-yl)phenyl]-4-fluorophenoxy]ethoxy]-5-fluorophenyl]-4-(2,4,4-trimethylpentan-2-yl)phenol;zirconium(2+)
CID 140778892
2-(2,7-ditert-butylcarbazol-9-yl)-6-[2-[3-[2-[3-(2,7-ditert-butylcarbazol-9-yl)-2-hydroxy-5-(2,4,4-trimethylpentan-2-yl)phenyl]-4-fluoro-6-propan-2-ylphenoxy]propoxy]-5-fluoro-3-propan-2-ylphenyl]-4-(2,4,4-trimethylpentan-2-yl)phenol
CID 140693164

Frequently Asked Questions

What is the IUPAC name of 4-tert-butyl-2-[2-[3-[2-[5-tert-butyl-3-(2,7-ditert-butylcarbazol-9-yl)-2-hydroxyphenyl]-4-fluoro-6-methylphenoxy]propoxy]-5-fluorophenyl]-6-(2,7-ditert-butylcarbazol-9-yl)phenol;2-[4-tert-butyl-2-[3-[2-[3-(2,7-ditert-butylcarbazol-9-yl)-2-hydroxy-5-(2,4,4-trimethylpentan-2-yl)phenyl]-4-fluoro-6-methylphenoxy]propoxy]-5-fluorophenyl]-6-(2,7-ditert-butylcarbazol-9-yl)-4-(2,4,4-trimethylpentan-2-yl)phenol;2-[2-[[(1R,2R)-2-[[2-[3-(7-tert-butyl-1,2,5-trimethylcarbazol-9-yl)-2-hydroxy-5-(2,4,4-trimethylpentan-2-yl)phenyl]-4-fluoro-6-methylphenoxy]methyl]cyclohexyl]methoxy]-5-fluoro-3-methylphenyl]-6-(2,7-ditert-butylcarbazol-9-yl)-4-(2,4,4-trimethylpentan-2-yl)phenol;carbanide;2-(2,7-ditert-butylcarbazol-9-yl)-6-[2-[3-[2-[3-(2,7-ditert-butylcarbazol-9-yl)-5-ethyl-2-hydroxyphenyl]-4,6-dimethylphenoxy]propoxy]-3,5-dimethylphenyl]-4-ethylphenol;hafnium?
The IUPAC name of 4-tert-butyl-2-[2-[3-[2-[5-tert-butyl-3-(2,7-ditert-butylcarbazol-9-yl)-2-hydroxyphenyl]-4-fluoro-6-methylphenoxy]propoxy]-5-fluorophenyl]-6-(2,7-ditert-butylcarbazol-9-yl)phenol;2-[4-tert-butyl-2-[3-[2-[3-(2,7-ditert-butylcarbazol-9-yl)-2-hydroxy-5-(2,4,4-trimethylpentan-2-yl)phenyl]-4-fluoro-6-methylphenoxy]propoxy]-5-fluorophenyl]-6-(2,7-ditert-butylcarbazol-9-yl)-4-(2,4,4-trimethylpentan-2-yl)phenol;2-[2-[[(1R,2R)-2-[[2-[3-(7-tert-butyl-1,2,5-trimethylcarbazol-9-yl)-2-hydroxy-5-(2,4,4-trimethylpentan-2-yl)phenyl]-4-fluoro-6-methylphenoxy]methyl]cyclohexyl]methoxy]-5-fluoro-3-methylphenyl]-6-(2,7-ditert-butylcarbazol-9-yl)-4-(2,4,4-trimethylpentan-2-yl)phenol;carbanide;2-(2,7-ditert-butylcarbazol-9-yl)-6-[2-[3-[2-[3-(2,7-ditert-butylcarbazol-9-yl)-5-ethyl-2-hydroxyphenyl]-4,6-dimethylphenoxy]propoxy]-3,5-dimethylphenyl]-4-ethylphenol;hafnium (CID 158852535) is 4-tert-butyl-2-[2-[3-[2-[5-tert-butyl-3-(2,7-ditert-butylcarbazol-9-yl)-2-hydroxyphenyl]-4-fluoro-6-methylphenoxy]propoxy]-5-fluorophenyl]-6-(2,7-ditert-butylcarbazol-9-yl)phenol;2-[4-tert-butyl-2-[3-[2-[3-(2,7-ditert-butylcarbazol-9-yl)-2-hydroxy-5-(2,4,4-trimethylpentan-2-yl)phenyl]-4-fluoro-6-methylphenoxy]propoxy]-5-fluorophenyl]-6-(2,7-ditert-butylcarbazol-9-yl)-4-(2,4,4-trimethylpentan-2-yl)phenol;2-[2-[[(1R,2R)-2-[[2-[3-(7-tert-butyl-1,2,5-trimethylcarbazol-9-yl)-2-hydroxy-5-(2,4,4-trimethylpentan-2-yl)phenyl]-4-fluoro-6-methylphenoxy]methyl]cyclohexyl]methoxy]-5-fluoro-3-methylphenyl]-6-(2,7-ditert-butylcarbazol-9-yl)-4-(2,4,4-trimethylpentan-2-yl)phenol;carbanide;2-(2,7-ditert-butylcarbazol-9-yl)-6-[2-[3-[2-[3-(2,7-ditert-butylcarbazol-9-yl)-5-ethyl-2-hydroxyphenyl]-4,6-dimethylphenoxy]propoxy]-3,5-dimethylphenyl]-4-ethylphenol;hafnium.
What is the SMILES notation for 4-tert-butyl-2-[2-[3-[2-[5-tert-butyl-3-(2,7-ditert-butylcarbazol-9-yl)-2-hydroxyphenyl]-4-fluoro-6-methylphenoxy]propoxy]-5-fluorophenyl]-6-(2,7-ditert-butylcarbazol-9-yl)phenol;2-[4-tert-butyl-2-[3-[2-[3-(2,7-ditert-butylcarbazol-9-yl)-2-hydroxy-5-(2,4,4-trimethylpentan-2-yl)phenyl]-4-fluoro-6-methylphenoxy]propoxy]-5-fluorophenyl]-6-(2,7-ditert-butylcarbazol-9-yl)-4-(2,4,4-trimethylpentan-2-yl)phenol;2-[2-[[(1R,2R)-2-[[2-[3-(7-tert-butyl-1,2,5-trimethylcarbazol-9-yl)-2-hydroxy-5-(2,4,4-trimethylpentan-2-yl)phenyl]-4-fluoro-6-methylphenoxy]methyl]cyclohexyl]methoxy]-5-fluoro-3-methylphenyl]-6-(2,7-ditert-butylcarbazol-9-yl)-4-(2,4,4-trimethylpentan-2-yl)phenol;carbanide;2-(2,7-ditert-butylcarbazol-9-yl)-6-[2-[3-[2-[3-(2,7-ditert-butylcarbazol-9-yl)-5-ethyl-2-hydroxyphenyl]-4,6-dimethylphenoxy]propoxy]-3,5-dimethylphenyl]-4-ethylphenol;hafnium?
The canonical SMILES for 4-tert-butyl-2-[2-[3-[2-[5-tert-butyl-3-(2,7-ditert-butylcarbazol-9-yl)-2-hydroxyphenyl]-4-fluoro-6-methylphenoxy]propoxy]-5-fluorophenyl]-6-(2,7-ditert-butylcarbazol-9-yl)phenol;2-[4-tert-butyl-2-[3-[2-[3-(2,7-ditert-butylcarbazol-9-yl)-2-hydroxy-5-(2,4,4-trimethylpentan-2-yl)phenyl]-4-fluoro-6-methylphenoxy]propoxy]-5-fluorophenyl]-6-(2,7-ditert-butylcarbazol-9-yl)-4-(2,4,4-trimethylpentan-2-yl)phenol;2-[2-[[(1R,2R)-2-[[2-[3-(7-tert-butyl-1,2,5-trimethylcarbazol-9-yl)-2-hydroxy-5-(2,4,4-trimethylpentan-2-yl)phenyl]-4-fluoro-6-methylphenoxy]methyl]cyclohexyl]methoxy]-5-fluoro-3-methylphenyl]-6-(2,7-ditert-butylcarbazol-9-yl)-4-(2,4,4-trimethylpentan-2-yl)phenol;carbanide;2-(2,7-ditert-butylcarbazol-9-yl)-6-[2-[3-[2-[3-(2,7-ditert-butylcarbazol-9-yl)-5-ethyl-2-hydroxyphenyl]-4,6-dimethylphenoxy]propoxy]-3,5-dimethylphenyl]-4-ethylphenol;hafnium is CCc1cc(-c2cc(C)cc(C)c2OCCCOc2c(C)cc(C)cc2-c2cc(CC)cc(-n3c4cc(C(C)(C)C)ccc4c4ccc(C(C)(C)C)cc43)c2O)c(O)c(-n2c3cc(C(C)(C)C)ccc3c3ccc(C(C)(C)C)cc32)c1.Cc1cc(F)cc(-c2cc(C(C)(C)C)cc(-n3c4cc(C(C)(C)C)ccc4c4ccc(C(C)(C)C)cc43)c2O)c1OCCCOc1ccc(F)cc1-c1cc(C(C)(C)C)cc(-n2c3cc(C(C)(C)C)ccc3c3ccc(C(C)(C)C)cc32)c1O.Cc1cc(F)cc(-c2cc(C(C)(C)CC(C)(C)C)cc(-n3c4cc(C(C)(C)C)ccc4c4ccc(C(C)(C)C)cc43)c2O)c1OCCCOc1cc(C(C)(C)C)c(F)cc1-c1cc(C(C)(C)CC(C)(C)C)cc(-n2c3cc(C(C)(C)C)ccc3c3ccc(C(C)(C)C)cc32)c1O.Cc1cc(F)cc(-c2cc(C(C)(C)CC(C)(C)C)cc(-n3c4cc(C(C)(C)C)ccc4c4ccc(C(C)(C)C)cc43)c2O)c1OC[C@@H]1CCCC[C@H]1COc1c(C)cc(F)cc1-c1cc(C(C)(C)CC(C)(C)C)cc(-n2c3cc(C(C)(C)C)cc(C)c3c3ccc(C)c(C)c32)c1O.[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[CH3-].[Hf].[Hf].[Hf].[Hf].
What is the InChIKey of 4-tert-butyl-2-[2-[3-[2-[5-tert-butyl-3-(2,7-ditert-butylcarbazol-9-yl)-2-hydroxyphenyl]-4-fluoro-6-methylphenoxy]propoxy]-5-fluorophenyl]-6-(2,7-ditert-butylcarbazol-9-yl)phenol;2-[4-tert-butyl-2-[3-[2-[3-(2,7-ditert-butylcarbazol-9-yl)-2-hydroxy-5-(2,4,4-trimethylpentan-2-yl)phenyl]-4-fluoro-6-methylphenoxy]propoxy]-5-fluorophenyl]-6-(2,7-ditert-butylcarbazol-9-yl)-4-(2,4,4-trimethylpentan-2-yl)phenol;2-[2-[[(1R,2R)-2-[[2-[3-(7-tert-butyl-1,2,5-trimethylcarbazol-9-yl)-2-hydroxy-5-(2,4,4-trimethylpentan-2-yl)phenyl]-4-fluoro-6-methylphenoxy]methyl]cyclohexyl]methoxy]-5-fluoro-3-methylphenyl]-6-(2,7-ditert-butylcarbazol-9-yl)-4-(2,4,4-trimethylpentan-2-yl)phenol;carbanide;2-(2,7-ditert-butylcarbazol-9-yl)-6-[2-[3-[2-[3-(2,7-ditert-butylcarbazol-9-yl)-5-ethyl-2-hydroxyphenyl]-4,6-dimethylphenoxy]propoxy]-3,5-dimethylphenyl]-4-ethylphenol;hafnium?
The InChIKey is NXTDJLBNKGYIKP-LETPZUJCSA-N. The full InChI is InChI=1S/C89H110F2N2O4.C88H110F2N2O4.C76H86F2N2O4.C75H86N2O4.8CH3.4Hf/c1-51-29-32-67-77-52(2)35-60(87(18,19)20)42-74(77)93(78(67)55(51)5)76-44-62(89(23,24)50-84(9,10)11)39-69(80(76)95)71-46-64(91)37-54(4)82(71)97-48-57-28-26-25-27-56(57)47-96-81-53(3)36-63(90)45-70(81)68-38-61(88(21,22)49-83(6,7)8)43-75(79(68)94)92-72-40-58(85(12,13)14)30-33-65(72)66-34-31-59(41-73(66)92)86(15,16)17;1-52-38-59(89)47-67(66-40-58(88(25,26)51-81(5,6)7)46-75(78(66)94)92-72-43-55(84(14,15)16)30-34-62(72)63-35-31-56(44-73(63)92)85(17,18)19)79(52)96-37-27-36-95-76-49-68(86(20,21)22)69(90)48-64(76)65-39-57(87(23,24)50-80(2,3)4)45-74(77(65)93)91-70-41-53(82(8,9)10)28-32-60(70)61-33-29-54(42-71(61)91)83(11,12)13;1-44-33-52(78)43-60(59-35-50(76(17,18)19)41-66(69(59)82)80-63-38-47(73(8,9)10)23-28-55(63)56-29-24-48(39-64(56)80)74(11,12)13)70(44)84-32-20-31-83-67-30-25-51(77)42-57(67)58-34-49(75(14,15)16)40-65(68(58)81)79-61-36-45(71(2,3)4)21-26-53(61)54-27-22-46(37-62(54)79)72(5,6)7;1-19-48-36-58(68(78)66(38-48)76-62-40-50(72(7,8)9)22-26-54(62)55-27-23-51(41-63(55)76)73(10,11)12)60-34-44(3)32-46(5)70(60)80-30-21-31-81-71-47(6)33-45(4)35-61(71)59-37-49(20-2)39-67(69(59)79)77-64-42-52(74(13,14)15)24-28-56(64)57-29-25-53(43-65(57)77)75(16,17)18;;;;;;;;;;;;/h29-46,56-57,94-95H,25-28,47-50H2,1-24H3;28-35,38-49,93-94H,27,36-37,50-51H2,1-26H3;21-30,33-43,81-82H,20,31-32H2,1-19H3;22-29,32-43,78-79H,19-21,30-31H2,1-18H3;8*1H3;;;;/q;;;;8*-1;;;;/t56-,57-;;;;;;;;;;;;;;;/m0.............../s1.
What are the key properties of 4-tert-butyl-2-[2-[3-[2-[5-tert-butyl-3-(2,7-ditert-butylcarbazol-9-yl)-2-hydroxyphenyl]-4-fluoro-6-methylphenoxy]propoxy]-5-fluorophenyl]-6-(2,7-ditert-butylcarbazol-9-yl)phenol;2-[4-tert-butyl-2-[3-[2-[3-(2,7-ditert-butylcarbazol-9-yl)-2-hydroxy-5-(2,4,4-trimethylpentan-2-yl)phenyl]-4-fluoro-6-methylphenoxy]propoxy]-5-fluorophenyl]-6-(2,7-ditert-butylcarbazol-9-yl)-4-(2,4,4-trimethylpentan-2-yl)phenol;2-[2-[[(1R,2R)-2-[[2-[3-(7-tert-butyl-1,2,5-trimethylcarbazol-9-yl)-2-hydroxy-5-(2,4,4-trimethylpentan-2-yl)phenyl]-4-fluoro-6-methylphenoxy]methyl]cyclohexyl]methoxy]-5-fluoro-3-methylphenyl]-6-(2,7-ditert-butylcarbazol-9-yl)-4-(2,4,4-trimethylpentan-2-yl)phenol;carbanide;2-(2,7-ditert-butylcarbazol-9-yl)-6-[2-[3-[2-[3-(2,7-ditert-butylcarbazol-9-yl)-5-ethyl-2-hydroxyphenyl]-4,6-dimethylphenoxy]propoxy]-3,5-dimethylphenyl]-4-ethylphenol;hafnium?
4-tert-butyl-2-[2-[3-[2-[5-tert-butyl-3-(2,7-ditert-butylcarbazol-9-yl)-2-hydroxyphenyl]-4-fluoro-6-methylphenoxy]propoxy]-5-fluorophenyl]-6-(2,7-ditert-butylcarbazol-9-yl)phenol;2-[4-tert-butyl-2-[3-[2-[3-(2,7-ditert-butylcarbazol-9-yl)-2-hydroxy-5-(2,4,4-trimethylpentan-2-yl)phenyl]-4-fluoro-6-methylphenoxy]propoxy]-5-fluorophenyl]-6-(2,7-ditert-butylcarbazol-9-yl)-4-(2,4,4-trimethylpentan-2-yl)phenol;2-[2-[[(1R,2R)-2-[[2-[3-(7-tert-butyl-1,2,5-trimethylcarbazol-9-yl)-2-hydroxy-5-(2,4,4-trimethylpentan-2-yl)phenyl]-4-fluoro-6-methylphenoxy]methyl]cyclohexyl]methoxy]-5-fluoro-3-methylphenyl]-6-(2,7-ditert-butylcarbazol-9-yl)-4-(2,4,4-trimethylpentan-2-yl)phenol;carbanide;2-(2,7-ditert-butylcarbazol-9-yl)-6-[2-[3-[2-[3-(2,7-ditert-butylcarbazol-9-yl)-5-ethyl-2-hydroxyphenyl]-4,6-dimethylphenoxy]propoxy]-3,5-dimethylphenyl]-4-ethylphenol;hafnium has a molecular weight of 5651.01 g/mol, XLogP of 94.47, 50 rotatable bonds, 8 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for 4-tert-butyl-2-[2-[3-[2-[5-tert-butyl-3-(2,7-ditert-butylcarbazol-9-yl)-2-hydroxyphenyl]-4-fluoro-6-methylphenoxy]propoxy]-5-fluorophenyl]-6-(2,7-ditert-butylcarbazol-9-yl)phenol;2-[4-tert-butyl-2-[3-[2-[3-(2,7-ditert-butylcarbazol-9-yl)-2-hydroxy-5-(2,4,4-trimethylpentan-2-yl)phenyl]-4-fluoro-6-methylphenoxy]propoxy]-5-fluorophenyl]-6-(2,7-ditert-butylcarbazol-9-yl)-4-(2,4,4-trimethylpentan-2-yl)phenol;2-[2-[[(1R,2R)-2-[[2-[3-(7-tert-butyl-1,2,5-trimethylcarbazol-9-yl)-2-hydroxy-5-(2,4,4-trimethylpentan-2-yl)phenyl]-4-fluoro-6-methylphenoxy]methyl]cyclohexyl]methoxy]-5-fluoro-3-methylphenyl]-6-(2,7-ditert-butylcarbazol-9-yl)-4-(2,4,4-trimethylpentan-2-yl)phenol;carbanide;2-(2,7-ditert-butylcarbazol-9-yl)-6-[2-[3-[2-[3-(2,7-ditert-butylcarbazol-9-yl)-5-ethyl-2-hydroxyphenyl]-4,6-dimethylphenoxy]propoxy]-3,5-dimethylphenyl]-4-ethylphenol;hafnium is sourced from PubChem (CID 158852535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).