9-[4-[9-(4-tert-butylphenyl)-2,7-dimethylfluoren-9-yl]phenyl]-3,6-di(carbazol-9-yl)carbazole;3,6-dibutyl-9-[9-[4-[9-(4-tert-butylphenyl)-2,7-dimethylfluoren-9-yl]phenyl]-6-(3,6-dibutylcarbazol-9-yl)carbazol-3-yl]carbazole;4-[4-[N-[4-(2,7-dimethyl-9-phenylfluoren-9-yl)phenyl]-4-[4-(N-phenylanilino)phenyl]anilino]phenyl]-N,N-diphenylaniline

C225H191N9 — CID 160709397

IUPAC9-[4-[9-(4-tert-butylphenyl)-2,7-dimethylfluoren-9-yl]phenyl]-3,6-di(carbazol-9-yl)carbazole;3,6-dibutyl-9-[9-[4-[9-(4-tert-butylphenyl)-2,7-dimethylfluoren-9-yl]phenyl]-6-(3,6-dibutylcarbazol-9-yl)carbazol-3-yl]carbazole;4-[4-[N-[4-(2,7-dimethyl-9-phenylfluoren-9-yl)phenyl]-4-[4-(N-phenylanilino)phenyl]anilino]phenyl]-N,N-diphenylaniline
SMILESCCCCc1ccc2c(c1)c1cc(CCCC)ccc1n2-c1ccc2c(c1)c1cc(-n3c4ccc(CCCC)cc4c4cc(CCCC)ccc43)ccc1n2-c1ccc(C2(c3ccc(C(C)(C)C)cc3)c3cc(C)ccc3-c3ccc(C)cc32)cc1.Cc1ccc2c(c1)C(c1ccc(-n3c4ccc(-n5c6ccccc6c6ccccc65)cc4c4cc(-n5c6ccccc6c6ccccc65)ccc43)cc1)(c1ccc(C(C)(C)C)cc1)c1cc(C)ccc1-2.Cc1ccc2c(c1)C(c1ccccc1)(c1ccc(N(c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)cc3)c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)cc3)cc1)c1cc(C)ccc1-2
InChIInChI=1S/C83H83N3.C75H57N3.C67H51N3/c1-10-14-18-56-24-40-76-68(48-56)69-49-57(19-15-11-2)25-41-77(69)85(76)64-36-44-80-72(52-64)73-53-65(86-78-42-26-58(20-16-12-3)50-70(78)71-51-59(21-17-13-4)27-43-79(71)86)37-45-81(73)84(80)63-34-32-62(33-35-63)83(61-30-28-60(29-31-61)82(7,8)9)74-46-54(5)22-38-66(74)67-39-23-55(6)47-75(67)83;1-54-28-50-71-72-51-29-55(2)53-74(72)75(73(71)52-54,60-18-8-3-9-19-60)61-38-48-70(49-39-61)78(68-44-34-58(35-45-68)56-30-40-66(41-31-56)76(62-20-10-4-11-21-62)63-22-12-5-13-23-63)69-46-36-59(37-47-69)57-32-42-67(43-33-57)77(64-24-14-6-15-25-64)65-26-16-7-17-27-65;1-42-22-34-50-51-35-23-43(2)39-59(51)67(58(50)38-42,45-26-24-44(25-27-45)66(3,4)5)46-28-30-47(31-29-46)68-64-36-32-48(69-60-18-10-6-14-52(60)53-15-7-11-19-61(53)69)40-56(64)57-41-49(33-37-65(57)68)70-62-20-12-8-16-54(62)55-17-9-13-21-63(55)70/h22-53H,10-21H2,1-9H3;3-53H,1-2H3;6-41H,1-5H3
InChIKeyRRQPYZKEVZBAMH-UHFFFAOYSA-N
MW3021.07 g/mol
LogP60.29
Rot. Bonds35

About 9-[4-[9-(4-tert-butylphenyl)-2,7-dimethylfluoren-9-yl]phenyl]-3,6-di(carbazol-9-yl)carbazole;3,6-dibutyl-9-[9-[4-[9-(4-tert-butylphenyl)-2,7-dimethylfluoren-9-yl]phenyl]-6-(3,6-dibutylcarbazol-9-yl)carbazol-3-yl]carbazole;4-[4-[N-[4-(2,7-dimethyl-9-phenylfluoren-9-yl)phenyl]-4-[4-(N-phenylanilino)phenyl]anilino]phenyl]-N,N-diphenylaniline

9-[4-[9-(4-tert-butylphenyl)-2,7-dimethylfluoren-9-yl]phenyl]-3,6-di(carbazol-9-yl)carbazole;3,6-dibutyl-9-[9-[4-[9-(4-tert-butylphenyl)-2,7-dimethylfluoren-9-yl]phenyl]-6-(3,6-dibutylcarbazol-9-yl)carbazol-3-yl]carbazole;4-[4-[N-[4-(2,7-dimethyl-9-phenylfluoren-9-yl)phenyl]-4-[4-(N-phenylanilino)phenyl]anilino]phenyl]-N,N-diphenylaniline (PubChem CID 160709397) has the molecular formula C225H191N9 and a molecular weight of 3021.07 g/mol. Its IUPAC name is 9-[4-[9-(4-tert-butylphenyl)-2,7-dimethylfluoren-9-yl]phenyl]-3,6-di(carbazol-9-yl)carbazole;3,6-dibutyl-9-[9-[4-[9-(4-tert-butylphenyl)-2,7-dimethylfluoren-9-yl]phenyl]-6-(3,6-dibutylcarbazol-9-yl)carbazol-3-yl]carbazole;4-[4-[N-[4-(2,7-dimethyl-9-phenylfluoren-9-yl)phenyl]-4-[4-(N-phenylanilino)phenyl]anilino]phenyl]-N,N-diphenylaniline.

Molecular Properties

Compound Name9-[4-[9-(4-tert-butylphenyl)-2,7-dimethylfluoren-9-yl]phenyl]-3,6-di(carbazol-9-yl)carbazole;3,6-dibutyl-9-[9-[4-[9-(4-tert-butylphenyl)-2,7-dimethylfluoren-9-yl]phenyl]-6-(3,6-dibutylcarbazol-9-yl)carbazol-3-yl]carbazole;4-[4-[N-[4-(2,7-dimethyl-9-phenylfluoren-9-yl)phenyl]-4-[4-(N-phenylanilino)phenyl]anilino]phenyl]-N,N-diphenylaniline
PubChem CID160709397
Molecular FormulaC225H191N9
Molecular Weight3021.07 g/mol
Exact Mass3018.52
IUPAC Name9-[4-[9-(4-tert-butylphenyl)-2,7-dimethylfluoren-9-yl]phenyl]-3,6-di(carbazol-9-yl)carbazole;3,6-dibutyl-9-[9-[4-[9-(4-tert-butylphenyl)-2,7-dimethylfluoren-9-yl]phenyl]-6-(3,6-dibutylcarbazol-9-yl)carbazol-3-yl]carbazole;4-[4-[N-[4-(2,7-dimethyl-9-phenylfluoren-9-yl)phenyl]-4-[4-(N-phenylanilino)phenyl]anilino]phenyl]-N,N-diphenylaniline
SMILESCCCCc1ccc2c(c1)c1cc(CCCC)ccc1n2-c1ccc2c(c1)c1cc(-n3c4ccc(CCCC)cc4c4cc(CCCC)ccc43)ccc1n2-c1ccc(C2(c3ccc(C(C)(C)C)cc3)c3cc(C)ccc3-c3ccc(C)cc32)cc1.Cc1ccc2c(c1)C(c1ccc(-n3c4ccc(-n5c6ccccc6c6ccccc65)cc4c4cc(-n5c6ccccc6c6ccccc65)ccc43)cc1)(c1ccc(C(C)(C)C)cc1)c1cc(C)ccc1-2.Cc1ccc2c(c1)C(c1ccccc1)(c1ccc(N(c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)cc3)c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)cc3)cc1)c1cc(C)ccc1-2
InChIInChI=1S/C83H83N3.C75H57N3.C67H51N3/c1-10-14-18-56-24-40-76-68(48-56)69-49-57(19-15-11-2)25-41-77(69)85(76)64-36-44-80-72(52-64)73-53-65(86-78-42-26-58(20-16-12-3)50-70(78)71-51-59(21-17-13-4)27-43-79(71)86)37-45-81(73)84(80)63-34-32-62(33-35-63)83(61-30-28-60(29-31-61)82(7,8)9)74-46-54(5)22-38-66(74)67-39-23-55(6)47-75(67)83;1-54-28-50-71-72-51-29-55(2)53-74(72)75(73(71)52-54,60-18-8-3-9-19-60)61-38-48-70(49-39-61)78(68-44-34-58(35-45-68)56-30-40-66(41-31-56)76(62-20-10-4-11-21-62)63-22-12-5-13-23-63)69-46-36-59(37-47-69)57-32-42-67(43-33-57)77(64-24-14-6-15-25-64)65-26-16-7-17-27-65;1-42-22-34-50-51-35-23-43(2)39-59(51)67(58(50)38-42,45-26-24-44(25-27-45)66(3,4)5)46-28-30-47(31-29-46)68-64-36-32-48(69-60-18-10-6-14-52(60)53-15-7-11-19-61(53)69)40-56(64)57-41-49(33-37-65(57)68)70-62-20-12-8-16-54(62)55-17-9-13-21-63(55)70/h22-53H,10-21H2,1-9H3;3-53H,1-2H3;6-41H,1-5H3
InChIKeyRRQPYZKEVZBAMH-UHFFFAOYSA-N
XLogP60.29
TPSA39.30 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds35
Heavy Atoms234
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5003021.07
LogP ≤ 560.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Analyze 9-[4-[9-(4-tert-butylphenyl)-2,7-dimethylfluoren-9-yl]phenyl]-3,6-di(carbazol-9-yl)carbazole;3,6-dibutyl-9-[9-[4-[9-(4-tert-butylphenyl)-2,7-dimethylfluoren-9-yl]phenyl]-6-(3,6-dibutylcarbazol-9-yl)carbazol-3-yl]carbazole;4-[4-[N-[4-(2,7-dimethyl-9-phenylfluoren-9-yl)phenyl]-4-[4-(N-phenylanilino)phenyl]anilino]phenyl]-N,N-diphenylaniline with MolForge

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Related Compounds

4-(4-tert-butylphenyl)-N-[4-[9-(4-hexylphenyl)-2,7-dimethylfluoren-9-yl]phenyl]-N-[4-[7,9,9-tris(4-hexylphenyl)fluoren-2-yl]phenyl]aniline
CID 58556150
7-methyl-N-(7-methyl-9,9-diphenylfluoren-2-yl)-9,9-diphenyl-N-[4-[6-phenyl-9-[4-(N-(3-phenylphenyl)anilino)phenyl]carbazol-3-yl]phenyl]fluoren-2-amine
CID 177287799
bis(N-(4-carbazol-9-ylphenyl)-2',7'-dimethyl-N-phenyl-9,9'-spirobi[fluorene]-2-amine);2',7'-ditert-butyl-N-(4-carbazol-9-ylphenyl)-N-phenyl-9,9'-spirobi[fluorene]-2-amine
CID 157386600
3-butyl-9-[4-(3-butyl-6-methylcarbazol-9-yl)phenyl]-6-methylcarbazole;N-[4-[4-(N-(4-butylphenyl)-4-methylanilino)phenyl]phenyl]-4-methyl-N-(4-methylphenyl)aniline
CID 123999534
N-[4-(3,6-ditert-butylcarbazol-9-yl)phenyl]-N-phenyl-4-(9-phenylcarbazol-3-yl)aniline;N-[4-(3,6-diethylcarbazol-9-yl)phenyl]-N-phenyl-4-(9-phenylcarbazol-3-yl)aniline;N-[4-(3,6-dimethylcarbazol-9-yl)phenyl]-N-phenyl-4-(9-phenylcarbazol-3-yl)aniline
CID 159264899
4-tert-butyl-N-[4-[4-[4-[4-(4-tert-butyl-N-(4-tert-butyl-2,6-dimethylphenyl)anilino)phenyl]-N-[4-[9-(4-hexylphenyl)-2,7-dimethylfluoren-9-yl]phenyl]anilino]phenyl]phenyl]-N-(4-tert-butylphenyl)-2,6-dimethylaniline
CID 140553747
7-[3-(9,9-dibutyl-7-methylfluoren-2-yl)-6-methylcarbazol-9-yl]-N,N-bis(4-methylphenyl)-9,9-diphenylfluoren-2-amine
CID 121324360
N-(4-tert-butylphenyl)-N-[4-[9-[9-(4-tert-butylphenyl)-6-[9-[4-(N-(4-tert-butylphenyl)anilino)phenyl]fluoren-9-yl]carbazol-3-yl]fluoren-9-yl]phenyl]-4-[9-(2-ethylhexyl)carbazol-3-yl]aniline
CID 59404168
4-tert-butyl-N-[4-[4-(4-tert-butyl-N-(4-tert-butyl-2,6-dimethylphenyl)anilino)phenyl]phenyl]-N-[4-[9-(4-hexylphenyl)-2,7-dimethylfluoren-9-yl]phenyl]-2,6-dimethylaniline
CID 140553755
N,9-diphenyl-N-[11-phenyl-11-(4-phenylphenyl)benzo[b]fluoren-2-yl]carbazol-3-amine
CID 167036355
4-(4-carbazol-9-ylphenyl)-N-[4-[4-(N-[4-(4-carbazol-9-ylphenyl)phenyl]anilino)phenyl]phenyl]-N-phenylaniline;N-[4-(3,6-ditert-butylcarbazol-9-yl)phenyl]-4-[4-(N-[4-(3,6-ditert-butylcarbazol-9-yl)phenyl]anilino)phenyl]-N-phenylaniline;N-[4-(3,6-diethylcarbazol-9-yl)phenyl]-4-[4-(N-[4-(3,6-diethylcarbazol-9-yl)phenyl]anilino)phenyl]-N-phenylaniline
CID 160593676
N-[4-(4-carbazol-9-ylphenyl)phenyl]-9,9-diphenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]fluoren-2-amine
CID 121381439

Frequently Asked Questions

What is the IUPAC name of 9-[4-[9-(4-tert-butylphenyl)-2,7-dimethylfluoren-9-yl]phenyl]-3,6-di(carbazol-9-yl)carbazole;3,6-dibutyl-9-[9-[4-[9-(4-tert-butylphenyl)-2,7-dimethylfluoren-9-yl]phenyl]-6-(3,6-dibutylcarbazol-9-yl)carbazol-3-yl]carbazole;4-[4-[N-[4-(2,7-dimethyl-9-phenylfluoren-9-yl)phenyl]-4-[4-(N-phenylanilino)phenyl]anilino]phenyl]-N,N-diphenylaniline?
The IUPAC name of 9-[4-[9-(4-tert-butylphenyl)-2,7-dimethylfluoren-9-yl]phenyl]-3,6-di(carbazol-9-yl)carbazole;3,6-dibutyl-9-[9-[4-[9-(4-tert-butylphenyl)-2,7-dimethylfluoren-9-yl]phenyl]-6-(3,6-dibutylcarbazol-9-yl)carbazol-3-yl]carbazole;4-[4-[N-[4-(2,7-dimethyl-9-phenylfluoren-9-yl)phenyl]-4-[4-(N-phenylanilino)phenyl]anilino]phenyl]-N,N-diphenylaniline (CID 160709397) is 9-[4-[9-(4-tert-butylphenyl)-2,7-dimethylfluoren-9-yl]phenyl]-3,6-di(carbazol-9-yl)carbazole;3,6-dibutyl-9-[9-[4-[9-(4-tert-butylphenyl)-2,7-dimethylfluoren-9-yl]phenyl]-6-(3,6-dibutylcarbazol-9-yl)carbazol-3-yl]carbazole;4-[4-[N-[4-(2,7-dimethyl-9-phenylfluoren-9-yl)phenyl]-4-[4-(N-phenylanilino)phenyl]anilino]phenyl]-N,N-diphenylaniline.
What is the SMILES notation for 9-[4-[9-(4-tert-butylphenyl)-2,7-dimethylfluoren-9-yl]phenyl]-3,6-di(carbazol-9-yl)carbazole;3,6-dibutyl-9-[9-[4-[9-(4-tert-butylphenyl)-2,7-dimethylfluoren-9-yl]phenyl]-6-(3,6-dibutylcarbazol-9-yl)carbazol-3-yl]carbazole;4-[4-[N-[4-(2,7-dimethyl-9-phenylfluoren-9-yl)phenyl]-4-[4-(N-phenylanilino)phenyl]anilino]phenyl]-N,N-diphenylaniline?
The canonical SMILES for 9-[4-[9-(4-tert-butylphenyl)-2,7-dimethylfluoren-9-yl]phenyl]-3,6-di(carbazol-9-yl)carbazole;3,6-dibutyl-9-[9-[4-[9-(4-tert-butylphenyl)-2,7-dimethylfluoren-9-yl]phenyl]-6-(3,6-dibutylcarbazol-9-yl)carbazol-3-yl]carbazole;4-[4-[N-[4-(2,7-dimethyl-9-phenylfluoren-9-yl)phenyl]-4-[4-(N-phenylanilino)phenyl]anilino]phenyl]-N,N-diphenylaniline is CCCCc1ccc2c(c1)c1cc(CCCC)ccc1n2-c1ccc2c(c1)c1cc(-n3c4ccc(CCCC)cc4c4cc(CCCC)ccc43)ccc1n2-c1ccc(C2(c3ccc(C(C)(C)C)cc3)c3cc(C)ccc3-c3ccc(C)cc32)cc1.Cc1ccc2c(c1)C(c1ccc(-n3c4ccc(-n5c6ccccc6c6ccccc65)cc4c4cc(-n5c6ccccc6c6ccccc65)ccc43)cc1)(c1ccc(C(C)(C)C)cc1)c1cc(C)ccc1-2.Cc1ccc2c(c1)C(c1ccccc1)(c1ccc(N(c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)cc3)c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)cc3)cc1)c1cc(C)ccc1-2.
What is the InChIKey of 9-[4-[9-(4-tert-butylphenyl)-2,7-dimethylfluoren-9-yl]phenyl]-3,6-di(carbazol-9-yl)carbazole;3,6-dibutyl-9-[9-[4-[9-(4-tert-butylphenyl)-2,7-dimethylfluoren-9-yl]phenyl]-6-(3,6-dibutylcarbazol-9-yl)carbazol-3-yl]carbazole;4-[4-[N-[4-(2,7-dimethyl-9-phenylfluoren-9-yl)phenyl]-4-[4-(N-phenylanilino)phenyl]anilino]phenyl]-N,N-diphenylaniline?
The InChIKey is RRQPYZKEVZBAMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C83H83N3.C75H57N3.C67H51N3/c1-10-14-18-56-24-40-76-68(48-56)69-49-57(19-15-11-2)25-41-77(69)85(76)64-36-44-80-72(52-64)73-53-65(86-78-42-26-58(20-16-12-3)50-70(78)71-51-59(21-17-13-4)27-43-79(71)86)37-45-81(73)84(80)63-34-32-62(33-35-63)83(61-30-28-60(29-31-61)82(7,8)9)74-46-54(5)22-38-66(74)67-39-23-55(6)47-75(67)83;1-54-28-50-71-72-51-29-55(2)53-74(72)75(73(71)52-54,60-18-8-3-9-19-60)61-38-48-70(49-39-61)78(68-44-34-58(35-45-68)56-30-40-66(41-31-56)76(62-20-10-4-11-21-62)63-22-12-5-13-23-63)69-46-36-59(37-47-69)57-32-42-67(43-33-57)77(64-24-14-6-15-25-64)65-26-16-7-17-27-65;1-42-22-34-50-51-35-23-43(2)39-59(51)67(58(50)38-42,45-26-24-44(25-27-45)66(3,4)5)46-28-30-47(31-29-46)68-64-36-32-48(69-60-18-10-6-14-52(60)53-15-7-11-19-61(53)69)40-56(64)57-41-49(33-37-65(57)68)70-62-20-12-8-16-54(62)55-17-9-13-21-63(55)70/h22-53H,10-21H2,1-9H3;3-53H,1-2H3;6-41H,1-5H3.
What are the key properties of 9-[4-[9-(4-tert-butylphenyl)-2,7-dimethylfluoren-9-yl]phenyl]-3,6-di(carbazol-9-yl)carbazole;3,6-dibutyl-9-[9-[4-[9-(4-tert-butylphenyl)-2,7-dimethylfluoren-9-yl]phenyl]-6-(3,6-dibutylcarbazol-9-yl)carbazol-3-yl]carbazole;4-[4-[N-[4-(2,7-dimethyl-9-phenylfluoren-9-yl)phenyl]-4-[4-(N-phenylanilino)phenyl]anilino]phenyl]-N,N-diphenylaniline?
9-[4-[9-(4-tert-butylphenyl)-2,7-dimethylfluoren-9-yl]phenyl]-3,6-di(carbazol-9-yl)carbazole;3,6-dibutyl-9-[9-[4-[9-(4-tert-butylphenyl)-2,7-dimethylfluoren-9-yl]phenyl]-6-(3,6-dibutylcarbazol-9-yl)carbazol-3-yl]carbazole;4-[4-[N-[4-(2,7-dimethyl-9-phenylfluoren-9-yl)phenyl]-4-[4-(N-phenylanilino)phenyl]anilino]phenyl]-N,N-diphenylaniline has a molecular weight of 3021.07 g/mol, XLogP of 60.29, 35 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[4-[9-(4-tert-butylphenyl)-2,7-dimethylfluoren-9-yl]phenyl]-3,6-di(carbazol-9-yl)carbazole;3,6-dibutyl-9-[9-[4-[9-(4-tert-butylphenyl)-2,7-dimethylfluoren-9-yl]phenyl]-6-(3,6-dibutylcarbazol-9-yl)carbazol-3-yl]carbazole;4-[4-[N-[4-(2,7-dimethyl-9-phenylfluoren-9-yl)phenyl]-4-[4-(N-phenylanilino)phenyl]anilino]phenyl]-N,N-diphenylaniline is sourced from PubChem (CID 160709397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).