5-(5-tert-butylthiophen-2-yl)-3-[2-[5-(5-tert-butylthiophen-2-yl)-2-[4-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]phenyl]thiophen-3-yl]-3,3,4,4,5,5-hexafluorocyclopenten-1-yl]-2-[4-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]phenyl]thiophene;5-(5-tert-butylthiophen-2-yl)-3-[2-[5-(5-tert-butylthiophen-2-yl)-2-[4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]thiophen-3-yl]-3,3,4,4,5,5-hexafluorocyclopenten-1-yl]-2-[4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]thiophene

C112H128F12O16S8 — CID 162100052

About 5-(5-tert-butylthiophen-2-yl)-3-[2-[5-(5-tert-butylthiophen-2-yl)-2-[4-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]phenyl]thiophen-3-yl]-3,3,4,4,5,5-hexafluorocyclopenten-1-yl]-2-[4-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]phenyl]thiophene;5-(5-tert-butylthiophen-2-yl)-3-[2-[5-(5-tert-butylthiophen-2-yl)-2-[4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]thiophen-3-yl]-3,3,4,4,5,5-hexafluorocyclopenten-1-yl]-2-[4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]thiophene

5-(5-tert-butylthiophen-2-yl)-3-[2-[5-(5-tert-butylthiophen-2-yl)-2-[4-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]phenyl]thiophen-3-yl]-3,3,4,4,5,5-hexafluorocyclopenten-1-yl]-2-[4-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]phenyl]thiophene;5-(5-tert-butylthiophen-2-yl)-3-[2-[5-(5-tert-butylthiophen-2-yl)-2-[4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]thiophen-3-yl]-3,3,4,4,5,5-hexafluorocyclopenten-1-yl]-2-[4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]thiophene (PubChem CID 162100052) has the molecular formula C112H128F12O16S8 and a molecular weight of 2214.75 g/mol. Its IUPAC name is 5-(5-tert-butylthiophen-2-yl)-3-[2-[5-(5-tert-butylthiophen-2-yl)-2-[4-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]phenyl]thiophen-3-yl]-3,3,4,4,5,5-hexafluorocyclopenten-1-yl]-2-[4-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]phenyl]thiophene;5-(5-tert-butylthiophen-2-yl)-3-[2-[5-(5-tert-butylthiophen-2-yl)-2-[4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]thiophen-3-yl]-3,3,4,4,5,5-hexafluorocyclopenten-1-yl]-2-[4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]thiophene.

Molecular Properties

• Compound Name: 5-(5-tert-butylthiophen-2-yl)-3-[2-[5-(5-tert-butylthiophen-2-yl)-2-[4-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]phenyl]thiophen-3-yl]-3,3,4,4,5,5-hexafluorocyclopenten-1-yl]-2-[4-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]phenyl]thiophene;5-(5-tert-butylthiophen-2-yl)-3-[2-[5-(5-tert-butylthiophen-2-yl)-2-[4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]thiophen-3-yl]-3,3,4,4,5,5-hexafluorocyclopenten-1-yl]-2-[4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]thiophene
• PubChem CID: 162100052
• Molecular Formula: C112H128F12O16S8
• Molecular Weight: 2214.75 g/mol
• Exact Mass: 2212.68
• IUPAC Name: 5-(5-tert-butylthiophen-2-yl)-3-[2-[5-(5-tert-butylthiophen-2-yl)-2-[4-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]phenyl]thiophen-3-yl]-3,3,4,4,5,5-hexafluorocyclopenten-1-yl]-2-[4-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]phenyl]thiophene;5-(5-tert-butylthiophen-2-yl)-3-[2-[5-(5-tert-butylthiophen-2-yl)-2-[4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]thiophen-3-yl]-3,3,4,4,5,5-hexafluorocyclopenten-1-yl]-2-[4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]thiophene
• SMILES: CCOCCOCCOCCOc1ccc(-c2sc(-c3ccc(C(C)(C)C)s3)cc2C2=C(c3cc(-c4ccc(C(C)(C)C)s4)sc3-c3ccc(OCCOCCOCCOCC)cc3)C(F)(F)C(F)(F)C2(F)F)cc1.COCCOCCOCCOc1ccc(-c2sc(-c3ccc(C(C)(C)C)s3)cc2C2=C(c3cc(-c4ccc(C(C)(C)C)s4)sc3-c3ccc(OCCOCCOCCOC)cc3)C(F)(F)C(F)(F)C2(F)F)cc1
• InChI: InChI=1S/C57H66F6O8S4.C55H62F6O8S4/c1-9-64-23-25-66-27-29-68-31-33-70-39-15-11-37(12-16-39)51-41(35-45(74-51)43-19-21-47(72-43)53(3,4)5)49-50(56(60,61)57(62,63)55(49,58)59)42-36-46(44-20-22-48(73-44)54(6,7)8)75-52(42)38-13-17-40(18-14-38)71-34-32-69-30-28-67-26-24-65-10-2;1-51(2,3)45-19-17-41(70-45)43-33-39(49(72-43)35-9-13-37(14-10-35)68-31-29-66-27-25-64-23-21-62-7)47-48(54(58,59)55(60,61)53(47,56)57)40-34-44(42-18-20-46(71-42)52(4,5)6)73-50(40)36-11-15-38(16-12-36)69-32-30-67-28-26-65-24-22-63-8/h11-22,35-36H,9-10,23-34H2,1-8H3;9-20,33-34H,21-32H2,1-8H3
• InChIKey: ZETJNAHAAHUJOG-UHFFFAOYSA-N
• XLogP: 31.07
• TPSA: 147.68 Ų
• H-Bond Acceptors: 24
• Rotatable Bonds: 54
• Heavy Atoms: 148
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2214.75
LogP ≤ 5	31.07
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	24

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 5-(5-tert-butylthiophen-2-yl)-3-[2-[5-(5-tert-butylthiophen-2-yl)-2-[4-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]phenyl]thiophen-3-yl]-3,3,4,4,5,5-hexafluorocyclopenten-1-yl]-2-[4-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]phenyl]thiophene;5-(5-tert-butylthiophen-2-yl)-3-[2-[5-(5-tert-butylthiophen-2-yl)-2-[4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]thiophen-3-yl]-3,3,4,4,5,5-hexafluorocyclopenten-1-yl]-2-[4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]thiophene?

The IUPAC name of 5-(5-tert-butylthiophen-2-yl)-3-[2-[5-(5-tert-butylthiophen-2-yl)-2-[4-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]phenyl]thiophen-3-yl]-3,3,4,4,5,5-hexafluorocyclopenten-1-yl]-2-[4-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]phenyl]thiophene;5-(5-tert-butylthiophen-2-yl)-3-[2-[5-(5-tert-butylthiophen-2-yl)-2-[4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]thiophen-3-yl]-3,3,4,4,5,5-hexafluorocyclopenten-1-yl]-2-[4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]thiophene (CID 162100052) is 5-(5-tert-butylthiophen-2-yl)-3-[2-[5-(5-tert-butylthiophen-2-yl)-2-[4-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]phenyl]thiophen-3-yl]-3,3,4,4,5,5-hexafluorocyclopenten-1-yl]-2-[4-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]phenyl]thiophene;5-(5-tert-butylthiophen-2-yl)-3-[2-[5-(5-tert-butylthiophen-2-yl)-2-[4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]thiophen-3-yl]-3,3,4,4,5,5-hexafluorocyclopenten-1-yl]-2-[4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]thiophene.

What is the SMILES notation for 5-(5-tert-butylthiophen-2-yl)-3-[2-[5-(5-tert-butylthiophen-2-yl)-2-[4-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]phenyl]thiophen-3-yl]-3,3,4,4,5,5-hexafluorocyclopenten-1-yl]-2-[4-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]phenyl]thiophene;5-(5-tert-butylthiophen-2-yl)-3-[2-[5-(5-tert-butylthiophen-2-yl)-2-[4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]thiophen-3-yl]-3,3,4,4,5,5-hexafluorocyclopenten-1-yl]-2-[4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]thiophene?

The canonical SMILES for 5-(5-tert-butylthiophen-2-yl)-3-[2-[5-(5-tert-butylthiophen-2-yl)-2-[4-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]phenyl]thiophen-3-yl]-3,3,4,4,5,5-hexafluorocyclopenten-1-yl]-2-[4-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]phenyl]thiophene;5-(5-tert-butylthiophen-2-yl)-3-[2-[5-(5-tert-butylthiophen-2-yl)-2-[4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]thiophen-3-yl]-3,3,4,4,5,5-hexafluorocyclopenten-1-yl]-2-[4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]thiophene is CCOCCOCCOCCOc1ccc(-c2sc(-c3ccc(C(C)(C)C)s3)cc2C2=C(c3cc(-c4ccc(C(C)(C)C)s4)sc3-c3ccc(OCCOCCOCCOCC)cc3)C(F)(F)C(F)(F)C2(F)F)cc1.COCCOCCOCCOc1ccc(-c2sc(-c3ccc(C(C)(C)C)s3)cc2C2=C(c3cc(-c4ccc(C(C)(C)C)s4)sc3-c3ccc(OCCOCCOCCOC)cc3)C(F)(F)C(F)(F)C2(F)F)cc1.

What is the InChIKey of 5-(5-tert-butylthiophen-2-yl)-3-[2-[5-(5-tert-butylthiophen-2-yl)-2-[4-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]phenyl]thiophen-3-yl]-3,3,4,4,5,5-hexafluorocyclopenten-1-yl]-2-[4-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]phenyl]thiophene;5-(5-tert-butylthiophen-2-yl)-3-[2-[5-(5-tert-butylthiophen-2-yl)-2-[4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]thiophen-3-yl]-3,3,4,4,5,5-hexafluorocyclopenten-1-yl]-2-[4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]thiophene?

The InChIKey is ZETJNAHAAHUJOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C57H66F6O8S4.C55H62F6O8S4/c1-9-64-23-25-66-27-29-68-31-33-70-39-15-11-37(12-16-39)51-41(35-45(74-51)43-19-21-47(72-43)53(3,4)5)49-50(56(60,61)57(62,63)55(49,58)59)42-36-46(44-20-22-48(73-44)54(6,7)8)75-52(42)38-13-17-40(18-14-38)71-34-32-69-30-28-67-26-24-65-10-2;1-51(2,3)45-19-17-41(70-45)43-33-39(49(72-43)35-9-13-37(14-10-35)68-31-29-66-27-25-64-23-21-62-7)47-48(54(58,59)55(60,61)53(47,56)57)40-34-44(42-18-20-46(71-42)52(4,5)6)73-50(40)36-11-15-38(16-12-36)69-32-30-67-28-26-65-24-22-63-8/h11-22,35-36H,9-10,23-34H2,1-8H3;9-20,33-34H,21-32H2,1-8H3.

What are the key properties of 5-(5-tert-butylthiophen-2-yl)-3-[2-[5-(5-tert-butylthiophen-2-yl)-2-[4-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]phenyl]thiophen-3-yl]-3,3,4,4,5,5-hexafluorocyclopenten-1-yl]-2-[4-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]phenyl]thiophene;5-(5-tert-butylthiophen-2-yl)-3-[2-[5-(5-tert-butylthiophen-2-yl)-2-[4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]thiophen-3-yl]-3,3,4,4,5,5-hexafluorocyclopenten-1-yl]-2-[4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]thiophene?

5-(5-tert-butylthiophen-2-yl)-3-[2-[5-(5-tert-butylthiophen-2-yl)-2-[4-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]phenyl]thiophen-3-yl]-3,3,4,4,5,5-hexafluorocyclopenten-1-yl]-2-[4-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]phenyl]thiophene;5-(5-tert-butylthiophen-2-yl)-3-[2-[5-(5-tert-butylthiophen-2-yl)-2-[4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]thiophen-3-yl]-3,3,4,4,5,5-hexafluorocyclopenten-1-yl]-2-[4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]thiophene has a molecular weight of 2214.75 g/mol, XLogP of 31.07, 54 rotatable bonds, 0 hydrogen bond donors, and 24 hydrogen bond acceptors.

Where does this data come from?

All data for 5-(5-tert-butylthiophen-2-yl)-3-[2-[5-(5-tert-butylthiophen-2-yl)-2-[4-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]phenyl]thiophen-3-yl]-3,3,4,4,5,5-hexafluorocyclopenten-1-yl]-2-[4-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]phenyl]thiophene;5-(5-tert-butylthiophen-2-yl)-3-[2-[5-(5-tert-butylthiophen-2-yl)-2-[4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]thiophen-3-yl]-3,3,4,4,5,5-hexafluorocyclopenten-1-yl]-2-[4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]thiophene is sourced from PubChem (CID 162100052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).