9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(4-tert-butylphenyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(4-methylphenyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis[4-(trifluoromethyl)phenyl]anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole

C174H102F42N6 — CID 158118033

IUPAC9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(4-tert-butylphenyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(4-methylphenyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis[4-(trifluoromethyl)phenyl]anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole
SMILESCC(C)(C)c1ccc(-c2c3ccc(-n4c5ccc(C(F)(F)F)cc5c5cc(C(F)(F)F)ccc54)cc3c(-c3ccc(C(C)(C)C)cc3)c3ccc(-n4c5ccc(C(F)(F)F)cc5c5cc(C(F)(F)F)ccc54)cc23)cc1.Cc1ccc(-c2c3ccc(-n4c5ccc(C(F)(F)F)cc5c5cc(C(F)(F)F)ccc54)cc3c(-c3ccc(C)cc3)c3ccc(-n4c5ccc(C(F)(F)F)cc5c5cc(C(F)(F)F)ccc54)cc23)cc1.FC(F)(F)c1ccc(-c2c3ccc(-n4c5ccc(C(F)(F)F)cc5c5cc(C(F)(F)F)ccc54)cc3c(-c3ccc(C(F)(F)F)cc3)c3ccc(-n4c5ccc(C(F)(F)F)cc5c5cc(C(F)(F)F)ccc54)cc23)cc1
InChIInChI=1S/C62H44F12N2.C56H26F18N2.C56H32F12N2/c1-57(2,3)35-11-7-33(8-12-35)55-43-21-19-42(76-53-25-17-39(61(69,70)71)29-47(53)48-30-40(62(72,73)74)18-26-54(48)76)32-50(43)56(34-9-13-36(14-10-34)58(4,5)6)44-22-20-41(31-49(44)55)75-51-23-15-37(59(63,64)65)27-45(51)46-28-38(60(66,67)68)16-24-52(46)75;57-51(58,59)29-5-1-27(2-6-29)49-37-15-13-36(76-47-19-11-33(55(69,70)71)23-41(47)42-24-34(56(72,73)74)12-20-48(42)76)26-44(37)50(28-3-7-30(8-4-28)52(60,61)62)38-16-14-35(25-43(38)49)75-45-17-9-31(53(63,64)65)21-39(45)40-22-32(54(66,67)68)10-18-46(40)75;1-29-3-7-31(8-4-29)51-39-17-15-38(70-49-21-13-35(55(63,64)65)25-43(49)44-26-36(56(66,67)68)14-22-50(44)70)28-46(39)52(32-9-5-30(2)6-10-32)40-18-16-37(27-45(40)51)69-47-19-11-33(53(57,58)59)23-41(47)42-24-34(54(60,61)62)12-20-48(42)69/h7-32H,1-6H3;1-26H;3-28H,1-2H3
InChIKeyFRGKOPNVBYTDDE-UHFFFAOYSA-N
MW3074.69 g/mol
LogP58.04
Rot. Bonds12

About 9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(4-tert-butylphenyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(4-methylphenyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis[4-(trifluoromethyl)phenyl]anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole

9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(4-tert-butylphenyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(4-methylphenyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis[4-(trifluoromethyl)phenyl]anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole (PubChem CID 158118033) has the molecular formula C174H102F42N6 and a molecular weight of 3074.69 g/mol. Its IUPAC name is 9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(4-tert-butylphenyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(4-methylphenyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis[4-(trifluoromethyl)phenyl]anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole.

Molecular Properties

Compound Name9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(4-tert-butylphenyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(4-methylphenyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis[4-(trifluoromethyl)phenyl]anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole
PubChem CID158118033
Molecular FormulaC174H102F42N6
Molecular Weight3074.69 g/mol
Exact Mass3072.75
IUPAC Name9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(4-tert-butylphenyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(4-methylphenyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis[4-(trifluoromethyl)phenyl]anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole
SMILESCC(C)(C)c1ccc(-c2c3ccc(-n4c5ccc(C(F)(F)F)cc5c5cc(C(F)(F)F)ccc54)cc3c(-c3ccc(C(C)(C)C)cc3)c3ccc(-n4c5ccc(C(F)(F)F)cc5c5cc(C(F)(F)F)ccc54)cc23)cc1.Cc1ccc(-c2c3ccc(-n4c5ccc(C(F)(F)F)cc5c5cc(C(F)(F)F)ccc54)cc3c(-c3ccc(C)cc3)c3ccc(-n4c5ccc(C(F)(F)F)cc5c5cc(C(F)(F)F)ccc54)cc23)cc1.FC(F)(F)c1ccc(-c2c3ccc(-n4c5ccc(C(F)(F)F)cc5c5cc(C(F)(F)F)ccc54)cc3c(-c3ccc(C(F)(F)F)cc3)c3ccc(-n4c5ccc(C(F)(F)F)cc5c5cc(C(F)(F)F)ccc54)cc23)cc1
InChIInChI=1S/C62H44F12N2.C56H26F18N2.C56H32F12N2/c1-57(2,3)35-11-7-33(8-12-35)55-43-21-19-42(76-53-25-17-39(61(69,70)71)29-47(53)48-30-40(62(72,73)74)18-26-54(48)76)32-50(43)56(34-9-13-36(14-10-34)58(4,5)6)44-22-20-41(31-49(44)55)75-51-23-15-37(59(63,64)65)27-45(51)46-28-38(60(66,67)68)16-24-52(46)75;57-51(58,59)29-5-1-27(2-6-29)49-37-15-13-36(76-47-19-11-33(55(69,70)71)23-41(47)42-24-34(56(72,73)74)12-20-48(42)76)26-44(37)50(28-3-7-30(8-4-28)52(60,61)62)38-16-14-35(25-43(38)49)75-45-17-9-31(53(63,64)65)21-39(45)40-22-32(54(66,67)68)10-18-46(40)75;1-29-3-7-31(8-4-29)51-39-17-15-38(70-49-21-13-35(55(63,64)65)25-43(49)44-26-36(56(66,67)68)14-22-50(44)70)28-46(39)52(32-9-5-30(2)6-10-32)40-18-16-37(27-45(40)51)69-47-19-11-33(53(57,58)59)23-41(47)42-24-34(54(60,61)62)12-20-48(42)69/h7-32H,1-6H3;1-26H;3-28H,1-2H3
InChIKeyFRGKOPNVBYTDDE-UHFFFAOYSA-N
XLogP58.04
TPSA29.58 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds12
Heavy Atoms222
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5003074.69
LogP ≤ 558.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

Analyze 9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(4-tert-butylphenyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(4-methylphenyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis[4-(trifluoromethyl)phenyl]anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole with MolForge

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Related Compounds

9-[6-(3,6-dicyanocarbazol-9-yl)-10-[4-(1,1-difluoroethyl)phenyl]-9-[4-(trifluoromethyl)phenyl]anthracen-2-yl]carbazole-3,6-dicarbonitrile
CID 89064680
[9-[6-[3,6-bis(trimethylsilyl)carbazol-9-yl]-9,10-bis[4-[4-(trifluoromethyl)phenyl]phenyl]anthracen-2-yl]-6-trimethylsilylcarbazol-3-yl]-trimethylsilane
CID 59357292
[9-[6-[3,6-bis(trimethylsilyl)carbazol-9-yl]-9,10-bis(4-tert-butylphenyl)anthracen-2-yl]-6-trimethylsilylcarbazol-3-yl]-trimethylsilane
CID 59357156
9-[4-[2-tert-butyl-10-(4-methylphenyl)anthracen-9-yl]phenyl]carbazole
CID 58991829
9-[3-[3-tert-butyl-10-(4-methylphenyl)anthracen-9-yl]phenyl]carbazole
CID 58991842
3,6-ditert-butyl-9-[6-(3,6-ditert-butylcarbazol-9-yl)-9,10-bis(3-phenylphenyl)anthracen-2-yl]carbazole;3,6-ditert-butyl-9-[6-(3,6-ditert-butylcarbazol-9-yl)-9,10-bis(4-phenylphenyl)anthracen-2-yl]carbazole
CID 157143874
4-[10-(4-cyanophenyl)-2,6-bis(3,6-ditert-butylcarbazol-9-yl)anthracen-9-yl]benzonitrile
CID 89064691
9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(5-methyl-2-pyridinyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-dipyridin-3-ylanthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole
CID 159051321
9-[9,10-bis(4-tert-butylphenyl)-6-carbazol-9-ylanthracen-2-yl]carbazole;9-[6-carbazol-9-yl-9,10-bis(3,5-dimethylphenyl)anthracen-2-yl]carbazole;9-[6-carbazol-9-yl-9,10-bis(4-methylphenyl)anthracen-2-yl]carbazole;9-[6-carbazol-9-yl-9,10-bis(2-phenylphenyl)anthracen-2-yl]carbazole;9-[6-carbazol-9-yl-9,10-bis(3-phenylphenyl)anthracen-2-yl]carbazole;9-[6-carbazol-9-yl-9,10-bis(4-phenylphenyl)anthracen-2-yl]carbazole
CID 158826661
9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-dinaphthalen-1-ylanthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole
CID 59357240
9-[9-(4-tert-butylphenyl)-6-carbazol-9-yl-10-naphthalen-2-ylanthracen-2-yl]carbazole
CID 59220991
3,6-ditert-butyl-9-[6-(3,6-ditert-butylcarbazol-9-yl)-9,10-bis(2-methylphenyl)anthracen-2-yl]carbazole;3,6-ditert-butyl-9-[6-(3,6-ditert-butylcarbazol-9-yl)-9,10-bis(3-methylphenyl)anthracen-2-yl]carbazole
CID 160622182

Frequently Asked Questions

What is the IUPAC name of 9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(4-tert-butylphenyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(4-methylphenyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis[4-(trifluoromethyl)phenyl]anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole?
The IUPAC name of 9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(4-tert-butylphenyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(4-methylphenyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis[4-(trifluoromethyl)phenyl]anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole (CID 158118033) is 9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(4-tert-butylphenyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(4-methylphenyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis[4-(trifluoromethyl)phenyl]anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole.
What is the SMILES notation for 9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(4-tert-butylphenyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(4-methylphenyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis[4-(trifluoromethyl)phenyl]anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole?
The canonical SMILES for 9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(4-tert-butylphenyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(4-methylphenyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis[4-(trifluoromethyl)phenyl]anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole is CC(C)(C)c1ccc(-c2c3ccc(-n4c5ccc(C(F)(F)F)cc5c5cc(C(F)(F)F)ccc54)cc3c(-c3ccc(C(C)(C)C)cc3)c3ccc(-n4c5ccc(C(F)(F)F)cc5c5cc(C(F)(F)F)ccc54)cc23)cc1.Cc1ccc(-c2c3ccc(-n4c5ccc(C(F)(F)F)cc5c5cc(C(F)(F)F)ccc54)cc3c(-c3ccc(C)cc3)c3ccc(-n4c5ccc(C(F)(F)F)cc5c5cc(C(F)(F)F)ccc54)cc23)cc1.FC(F)(F)c1ccc(-c2c3ccc(-n4c5ccc(C(F)(F)F)cc5c5cc(C(F)(F)F)ccc54)cc3c(-c3ccc(C(F)(F)F)cc3)c3ccc(-n4c5ccc(C(F)(F)F)cc5c5cc(C(F)(F)F)ccc54)cc23)cc1.
What is the InChIKey of 9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(4-tert-butylphenyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(4-methylphenyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis[4-(trifluoromethyl)phenyl]anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole?
The InChIKey is FRGKOPNVBYTDDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C62H44F12N2.C56H26F18N2.C56H32F12N2/c1-57(2,3)35-11-7-33(8-12-35)55-43-21-19-42(76-53-25-17-39(61(69,70)71)29-47(53)48-30-40(62(72,73)74)18-26-54(48)76)32-50(43)56(34-9-13-36(14-10-34)58(4,5)6)44-22-20-41(31-49(44)55)75-51-23-15-37(59(63,64)65)27-45(51)46-28-38(60(66,67)68)16-24-52(46)75;57-51(58,59)29-5-1-27(2-6-29)49-37-15-13-36(76-47-19-11-33(55(69,70)71)23-41(47)42-24-34(56(72,73)74)12-20-48(42)76)26-44(37)50(28-3-7-30(8-4-28)52(60,61)62)38-16-14-35(25-43(38)49)75-45-17-9-31(53(63,64)65)21-39(45)40-22-32(54(66,67)68)10-18-46(40)75;1-29-3-7-31(8-4-29)51-39-17-15-38(70-49-21-13-35(55(63,64)65)25-43(49)44-26-36(56(66,67)68)14-22-50(44)70)28-46(39)52(32-9-5-30(2)6-10-32)40-18-16-37(27-45(40)51)69-47-19-11-33(53(57,58)59)23-41(47)42-24-34(54(60,61)62)12-20-48(42)69/h7-32H,1-6H3;1-26H;3-28H,1-2H3.
What are the key properties of 9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(4-tert-butylphenyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(4-methylphenyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis[4-(trifluoromethyl)phenyl]anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole?
9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(4-tert-butylphenyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(4-methylphenyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis[4-(trifluoromethyl)phenyl]anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole has a molecular weight of 3074.69 g/mol, XLogP of 58.04, 12 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(4-tert-butylphenyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis(4-methylphenyl)anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole;9-[6-[3,6-bis(trifluoromethyl)carbazol-9-yl]-9,10-bis[4-(trifluoromethyl)phenyl]anthracen-2-yl]-3,6-bis(trifluoromethyl)carbazole is sourced from PubChem (CID 158118033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).