3-tert-butyl-6-[4-[4-[2,6-ditert-butyl-10-(4-phenylphenyl)anthracen-9-yl]phenyl]phenyl]-9-ethylcarbazole;3-tert-butyl-6-[4-[4-[2,6-ditert-butyl-10-[4-(4-phenylphenyl)phenyl]anthracen-9-yl]phenyl]phenyl]-9-ethylcarbazole

C134H126N2 — CID 158234538

IUPAC3-tert-butyl-6-[4-[4-[2,6-ditert-butyl-10-(4-phenylphenyl)anthracen-9-yl]phenyl]phenyl]-9-ethylcarbazole;3-tert-butyl-6-[4-[4-[2,6-ditert-butyl-10-[4-(4-phenylphenyl)phenyl]anthracen-9-yl]phenyl]phenyl]-9-ethylcarbazole
SMILESCCn1c2ccc(-c3ccc(-c4ccc(-c5c6ccc(C(C)(C)C)cc6c(-c6ccc(-c7ccc(-c8ccccc8)cc7)cc6)c6ccc(C(C)(C)C)cc56)cc4)cc3)cc2c2cc(C(C)(C)C)ccc21.CCn1c2ccc(-c3ccc(-c4ccc(-c5c6ccc(C(C)(C)C)cc6c(-c6ccc(-c7ccccc7)cc6)c6ccc(C(C)(C)C)cc56)cc4)cc3)cc2c2cc(C(C)(C)C)ccc21
InChIInChI=1S/C70H65N.C64H61N/c1-11-71-64-39-33-54(41-60(64)61-42-57(70(8,9)10)36-40-65(61)71)51-23-21-48(22-24-51)50-27-31-53(32-28-50)67-59-38-35-55(68(2,3)4)43-62(59)66(58-37-34-56(44-63(58)67)69(5,6)7)52-29-25-49(26-30-52)47-19-17-46(18-20-47)45-15-13-12-14-16-45;1-11-65-58-35-29-48(37-54(58)55-38-51(64(8,9)10)32-36-59(55)65)45-19-17-43(18-20-45)44-23-27-47(28-24-44)61-53-34-31-49(62(2,3)4)39-56(53)60(52-33-30-50(40-57(52)61)63(5,6)7)46-25-21-42(22-26-46)41-15-13-12-14-16-41/h12-44H,11H2,1-10H3;12-40H,11H2,1-10H3
InChIKeyGEULULXDHBICSO-UHFFFAOYSA-N
MW1764.50 g/mol
LogP38.36
Rot. Bonds13

About 3-tert-butyl-6-[4-[4-[2,6-ditert-butyl-10-(4-phenylphenyl)anthracen-9-yl]phenyl]phenyl]-9-ethylcarbazole;3-tert-butyl-6-[4-[4-[2,6-ditert-butyl-10-[4-(4-phenylphenyl)phenyl]anthracen-9-yl]phenyl]phenyl]-9-ethylcarbazole

3-tert-butyl-6-[4-[4-[2,6-ditert-butyl-10-(4-phenylphenyl)anthracen-9-yl]phenyl]phenyl]-9-ethylcarbazole;3-tert-butyl-6-[4-[4-[2,6-ditert-butyl-10-[4-(4-phenylphenyl)phenyl]anthracen-9-yl]phenyl]phenyl]-9-ethylcarbazole (PubChem CID 158234538) has the molecular formula C134H126N2 and a molecular weight of 1764.50 g/mol. Its IUPAC name is 3-tert-butyl-6-[4-[4-[2,6-ditert-butyl-10-(4-phenylphenyl)anthracen-9-yl]phenyl]phenyl]-9-ethylcarbazole;3-tert-butyl-6-[4-[4-[2,6-ditert-butyl-10-[4-(4-phenylphenyl)phenyl]anthracen-9-yl]phenyl]phenyl]-9-ethylcarbazole.

Molecular Properties

Compound Name3-tert-butyl-6-[4-[4-[2,6-ditert-butyl-10-(4-phenylphenyl)anthracen-9-yl]phenyl]phenyl]-9-ethylcarbazole;3-tert-butyl-6-[4-[4-[2,6-ditert-butyl-10-[4-(4-phenylphenyl)phenyl]anthracen-9-yl]phenyl]phenyl]-9-ethylcarbazole
PubChem CID158234538
Molecular FormulaC134H126N2
Molecular Weight1764.50 g/mol
Exact Mass1762.99
IUPAC Name3-tert-butyl-6-[4-[4-[2,6-ditert-butyl-10-(4-phenylphenyl)anthracen-9-yl]phenyl]phenyl]-9-ethylcarbazole;3-tert-butyl-6-[4-[4-[2,6-ditert-butyl-10-[4-(4-phenylphenyl)phenyl]anthracen-9-yl]phenyl]phenyl]-9-ethylcarbazole
SMILESCCn1c2ccc(-c3ccc(-c4ccc(-c5c6ccc(C(C)(C)C)cc6c(-c6ccc(-c7ccc(-c8ccccc8)cc7)cc6)c6ccc(C(C)(C)C)cc56)cc4)cc3)cc2c2cc(C(C)(C)C)ccc21.CCn1c2ccc(-c3ccc(-c4ccc(-c5c6ccc(C(C)(C)C)cc6c(-c6ccc(-c7ccccc7)cc6)c6ccc(C(C)(C)C)cc56)cc4)cc3)cc2c2cc(C(C)(C)C)ccc21
InChIInChI=1S/C70H65N.C64H61N/c1-11-71-64-39-33-54(41-60(64)61-42-57(70(8,9)10)36-40-65(61)71)51-23-21-48(22-24-51)50-27-31-53(32-28-50)67-59-38-35-55(68(2,3)4)43-62(59)66(58-37-34-56(44-63(58)67)69(5,6)7)52-29-25-49(26-30-52)47-19-17-46(18-20-47)45-15-13-12-14-16-45;1-11-65-58-35-29-48(37-54(58)55-38-51(64(8,9)10)32-36-59(55)65)45-19-17-43(18-20-45)44-23-27-47(28-24-44)61-53-34-31-49(62(2,3)4)39-56(53)60(52-33-30-50(40-57(52)61)63(5,6)7)46-25-21-42(22-26-46)41-15-13-12-14-16-41/h12-44H,11H2,1-10H3;12-40H,11H2,1-10H3
InChIKeyGEULULXDHBICSO-UHFFFAOYSA-N
XLogP38.36
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds13
Heavy Atoms136
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001764.50
LogP ≤ 538.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 3-tert-butyl-6-[4-[4-[2,6-ditert-butyl-10-(4-phenylphenyl)anthracen-9-yl]phenyl]phenyl]-9-ethylcarbazole;3-tert-butyl-6-[4-[4-[2,6-ditert-butyl-10-[4-(4-phenylphenyl)phenyl]anthracen-9-yl]phenyl]phenyl]-9-ethylcarbazole with MolForge

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Related Compounds

3-[4-[4-(2,6-ditert-butyl-10-phenylanthracen-9-yl)phenyl]phenyl]-9-ethyl-6-phenylcarbazole;3-[4-[4-[2,6-ditert-butyl-10-(4-phenylphenyl)anthracen-9-yl]phenyl]phenyl]-9-ethyl-6-phenylcarbazole
CID 159993393
9-ethyl-3-[4-[10-[4-(9-ethyl-6-phenylcarbazol-3-yl)phenyl]anthracen-9-yl]phenyl]-6-(4-phenylphenyl)carbazole;9-ethyl-3-[4-[4-[10-[4-[4-(9-ethyl-6-phenylcarbazol-3-yl)phenyl]phenyl]anthracen-9-yl]phenyl]phenyl]-6-(4-phenylphenyl)carbazole
CID 158925284
2-[6-[4-[2,6-dimethyl-10-(4-phenylphenyl)anthracen-9-yl]phenyl]-9-ethylcarbazol-3-yl]-2-methylpropanenitrile
CID 163956469
3-tert-butyl-6-[4-[4-(2,6-ditert-butyl-10-phenylanthracen-9-yl)phenyl]phenyl]-9-phenylcarbazole;3-tert-butyl-6-[4-[4-[2,6-ditert-butyl-10-[4-(4-phenylphenyl)phenyl]anthracen-9-yl]phenyl]phenyl]-9-phenylcarbazole
CID 161415057
2,7-bis[4-(4-tert-butylphenyl)phenyl]-9,10-diphenylanthracene
CID 59745944
9-ethyl-3-[4-[4-[2,3,6,7-tetramethyl-10-(4-phenylphenyl)anthracen-9-yl]phenyl]phenyl]carbazole;9-ethyl-3-[4-[4-[2,3,6,7-tetramethyl-10-[4-(4-phenylphenyl)phenyl]anthracen-9-yl]phenyl]phenyl]carbazole
CID 161126635
2-tert-butyl-9,10-bis(3-phenylphenyl)anthracene
CID 58672219
9-ethyl-3-phenyl-6-(3-phenylphenyl)carbazole
CID 167189399
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
2-tert-butyl-9,10-dinaphthalen-2-yl-6-phenylanthracene
CID 59342691
2-tert-butyl-6-(4-methoxyphenyl)-9,10-bis(4-phenylphenyl)anthracene
CID 59002256
3-[4-[4-[2,6-bis(3-methylphenyl)-10-[4-(4-phenylphenyl)phenyl]anthracen-9-yl]phenyl]phenyl]-9-ethylcarbazole;3-[4-(2,3-dimethyl-10-phenylanthracen-9-yl)phenyl]-9-ethylcarbazole
CID 160737474

Frequently Asked Questions

What is the IUPAC name of 3-tert-butyl-6-[4-[4-[2,6-ditert-butyl-10-(4-phenylphenyl)anthracen-9-yl]phenyl]phenyl]-9-ethylcarbazole;3-tert-butyl-6-[4-[4-[2,6-ditert-butyl-10-[4-(4-phenylphenyl)phenyl]anthracen-9-yl]phenyl]phenyl]-9-ethylcarbazole?
The IUPAC name of 3-tert-butyl-6-[4-[4-[2,6-ditert-butyl-10-(4-phenylphenyl)anthracen-9-yl]phenyl]phenyl]-9-ethylcarbazole;3-tert-butyl-6-[4-[4-[2,6-ditert-butyl-10-[4-(4-phenylphenyl)phenyl]anthracen-9-yl]phenyl]phenyl]-9-ethylcarbazole (CID 158234538) is 3-tert-butyl-6-[4-[4-[2,6-ditert-butyl-10-(4-phenylphenyl)anthracen-9-yl]phenyl]phenyl]-9-ethylcarbazole;3-tert-butyl-6-[4-[4-[2,6-ditert-butyl-10-[4-(4-phenylphenyl)phenyl]anthracen-9-yl]phenyl]phenyl]-9-ethylcarbazole.
What is the SMILES notation for 3-tert-butyl-6-[4-[4-[2,6-ditert-butyl-10-(4-phenylphenyl)anthracen-9-yl]phenyl]phenyl]-9-ethylcarbazole;3-tert-butyl-6-[4-[4-[2,6-ditert-butyl-10-[4-(4-phenylphenyl)phenyl]anthracen-9-yl]phenyl]phenyl]-9-ethylcarbazole?
The canonical SMILES for 3-tert-butyl-6-[4-[4-[2,6-ditert-butyl-10-(4-phenylphenyl)anthracen-9-yl]phenyl]phenyl]-9-ethylcarbazole;3-tert-butyl-6-[4-[4-[2,6-ditert-butyl-10-[4-(4-phenylphenyl)phenyl]anthracen-9-yl]phenyl]phenyl]-9-ethylcarbazole is CCn1c2ccc(-c3ccc(-c4ccc(-c5c6ccc(C(C)(C)C)cc6c(-c6ccc(-c7ccc(-c8ccccc8)cc7)cc6)c6ccc(C(C)(C)C)cc56)cc4)cc3)cc2c2cc(C(C)(C)C)ccc21.CCn1c2ccc(-c3ccc(-c4ccc(-c5c6ccc(C(C)(C)C)cc6c(-c6ccc(-c7ccccc7)cc6)c6ccc(C(C)(C)C)cc56)cc4)cc3)cc2c2cc(C(C)(C)C)ccc21.
What is the InChIKey of 3-tert-butyl-6-[4-[4-[2,6-ditert-butyl-10-(4-phenylphenyl)anthracen-9-yl]phenyl]phenyl]-9-ethylcarbazole;3-tert-butyl-6-[4-[4-[2,6-ditert-butyl-10-[4-(4-phenylphenyl)phenyl]anthracen-9-yl]phenyl]phenyl]-9-ethylcarbazole?
The InChIKey is GEULULXDHBICSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C70H65N.C64H61N/c1-11-71-64-39-33-54(41-60(64)61-42-57(70(8,9)10)36-40-65(61)71)51-23-21-48(22-24-51)50-27-31-53(32-28-50)67-59-38-35-55(68(2,3)4)43-62(59)66(58-37-34-56(44-63(58)67)69(5,6)7)52-29-25-49(26-30-52)47-19-17-46(18-20-47)45-15-13-12-14-16-45;1-11-65-58-35-29-48(37-54(58)55-38-51(64(8,9)10)32-36-59(55)65)45-19-17-43(18-20-45)44-23-27-47(28-24-44)61-53-34-31-49(62(2,3)4)39-56(53)60(52-33-30-50(40-57(52)61)63(5,6)7)46-25-21-42(22-26-46)41-15-13-12-14-16-41/h12-44H,11H2,1-10H3;12-40H,11H2,1-10H3.
What are the key properties of 3-tert-butyl-6-[4-[4-[2,6-ditert-butyl-10-(4-phenylphenyl)anthracen-9-yl]phenyl]phenyl]-9-ethylcarbazole;3-tert-butyl-6-[4-[4-[2,6-ditert-butyl-10-[4-(4-phenylphenyl)phenyl]anthracen-9-yl]phenyl]phenyl]-9-ethylcarbazole?
3-tert-butyl-6-[4-[4-[2,6-ditert-butyl-10-(4-phenylphenyl)anthracen-9-yl]phenyl]phenyl]-9-ethylcarbazole;3-tert-butyl-6-[4-[4-[2,6-ditert-butyl-10-[4-(4-phenylphenyl)phenyl]anthracen-9-yl]phenyl]phenyl]-9-ethylcarbazole has a molecular weight of 1764.50 g/mol, XLogP of 38.36, 13 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-tert-butyl-6-[4-[4-[2,6-ditert-butyl-10-(4-phenylphenyl)anthracen-9-yl]phenyl]phenyl]-9-ethylcarbazole;3-tert-butyl-6-[4-[4-[2,6-ditert-butyl-10-[4-(4-phenylphenyl)phenyl]anthracen-9-yl]phenyl]phenyl]-9-ethylcarbazole is sourced from PubChem (CID 158234538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).