9-[4-(4-ethenylphenoxy)phenyl]-N-[9-[4-(4-ethenylphenoxy)phenyl]-9-(2,3,5,6-tetrafluorophenyl)fluoren-2-yl]-N-(4-fluorophenyl)-9-(2,3,5,6-tetrafluorophenyl)fluoren-2-amine

C72H42F9NO2 — CID 167160973

About 9-[4-(4-ethenylphenoxy)phenyl]-N-[9-[4-(4-ethenylphenoxy)phenyl]-9-(2,3,5,6-tetrafluorophenyl)fluoren-2-yl]-N-(4-fluorophenyl)-9-(2,3,5,6-tetrafluorophenyl)fluoren-2-amine

9-[4-(4-ethenylphenoxy)phenyl]-N-[9-[4-(4-ethenylphenoxy)phenyl]-9-(2,3,5,6-tetrafluorophenyl)fluoren-2-yl]-N-(4-fluorophenyl)-9-(2,3,5,6-tetrafluorophenyl)fluoren-2-amine (PubChem CID 167160973) has the molecular formula C72H42F9NO2 and a molecular weight of 1124.12 g/mol. Its IUPAC name is 9-[4-(4-ethenylphenoxy)phenyl]-N-[9-[4-(4-ethenylphenoxy)phenyl]-9-(2,3,5,6-tetrafluorophenyl)fluoren-2-yl]-N-(4-fluorophenyl)-9-(2,3,5,6-tetrafluorophenyl)fluoren-2-amine.

Molecular Properties

• Compound Name: 9-[4-(4-ethenylphenoxy)phenyl]-N-[9-[4-(4-ethenylphenoxy)phenyl]-9-(2,3,5,6-tetrafluorophenyl)fluoren-2-yl]-N-(4-fluorophenyl)-9-(2,3,5,6-tetrafluorophenyl)fluoren-2-amine
• PubChem CID: 167160973
• Molecular Formula: C72H42F9NO2
• Molecular Weight: 1124.12 g/mol
• Exact Mass: 1123.31
• IUPAC Name: 9-[4-(4-ethenylphenoxy)phenyl]-N-[9-[4-(4-ethenylphenoxy)phenyl]-9-(2,3,5,6-tetrafluorophenyl)fluoren-2-yl]-N-(4-fluorophenyl)-9-(2,3,5,6-tetrafluorophenyl)fluoren-2-amine
• SMILES: C=Cc1ccc(Oc2ccc(C3(c4c(F)c(F)cc(F)c4F)c4ccccc4-c4ccc(N(c5ccc(F)cc5)c5ccc6c(c5)C(c5ccc(Oc7ccc(C=C)cc7)cc5)(c5c(F)c(F)cc(F)c5F)c5ccccc5-6)cc43)cc2)cc1
• InChI: InChI=1S/C72H42F9NO2/c1-3-41-13-27-49(28-14-41)83-51-31-17-43(18-32-51)71(65-67(78)61(74)39-62(75)68(65)79)57-11-7-5-9-53(57)55-35-25-47(37-59(55)71)82(46-23-21-45(73)22-24-46)48-26-36-56-54-10-6-8-12-58(54)72(60(56)38-48,66-69(80)63(76)40-64(77)70(66)81)44-19-33-52(34-20-44)84-50-29-15-42(4-2)16-30-50/h3-40H,1-2H2
• InChIKey: JPVODPRIRVZOSQ-UHFFFAOYSA-N
• XLogP: 20.01
• TPSA: 21.70 Ų
• H-Bond Acceptors: 3
• Rotatable Bonds: 13
• Heavy Atoms: 84
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1124.12
LogP ≤ 5	20.01
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	3

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 9-[4-(4-ethenylphenoxy)phenyl]-N-[9-[4-(4-ethenylphenoxy)phenyl]-9-(2,3,5,6-tetrafluorophenyl)fluoren-2-yl]-N-(4-fluorophenyl)-9-(2,3,5,6-tetrafluorophenyl)fluoren-2-amine?

The IUPAC name of 9-[4-(4-ethenylphenoxy)phenyl]-N-[9-[4-(4-ethenylphenoxy)phenyl]-9-(2,3,5,6-tetrafluorophenyl)fluoren-2-yl]-N-(4-fluorophenyl)-9-(2,3,5,6-tetrafluorophenyl)fluoren-2-amine (CID 167160973) is 9-[4-(4-ethenylphenoxy)phenyl]-N-[9-[4-(4-ethenylphenoxy)phenyl]-9-(2,3,5,6-tetrafluorophenyl)fluoren-2-yl]-N-(4-fluorophenyl)-9-(2,3,5,6-tetrafluorophenyl)fluoren-2-amine.

What is the SMILES notation for 9-[4-(4-ethenylphenoxy)phenyl]-N-[9-[4-(4-ethenylphenoxy)phenyl]-9-(2,3,5,6-tetrafluorophenyl)fluoren-2-yl]-N-(4-fluorophenyl)-9-(2,3,5,6-tetrafluorophenyl)fluoren-2-amine?

The canonical SMILES for 9-[4-(4-ethenylphenoxy)phenyl]-N-[9-[4-(4-ethenylphenoxy)phenyl]-9-(2,3,5,6-tetrafluorophenyl)fluoren-2-yl]-N-(4-fluorophenyl)-9-(2,3,5,6-tetrafluorophenyl)fluoren-2-amine is C=Cc1ccc(Oc2ccc(C3(c4c(F)c(F)cc(F)c4F)c4ccccc4-c4ccc(N(c5ccc(F)cc5)c5ccc6c(c5)C(c5ccc(Oc7ccc(C=C)cc7)cc5)(c5c(F)c(F)cc(F)c5F)c5ccccc5-6)cc43)cc2)cc1.

What is the InChIKey of 9-[4-(4-ethenylphenoxy)phenyl]-N-[9-[4-(4-ethenylphenoxy)phenyl]-9-(2,3,5,6-tetrafluorophenyl)fluoren-2-yl]-N-(4-fluorophenyl)-9-(2,3,5,6-tetrafluorophenyl)fluoren-2-amine?

The InChIKey is JPVODPRIRVZOSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C72H42F9NO2/c1-3-41-13-27-49(28-14-41)83-51-31-17-43(18-32-51)71(65-67(78)61(74)39-62(75)68(65)79)57-11-7-5-9-53(57)55-35-25-47(37-59(55)71)82(46-23-21-45(73)22-24-46)48-26-36-56-54-10-6-8-12-58(54)72(60(56)38-48,66-69(80)63(76)40-64(77)70(66)81)44-19-33-52(34-20-44)84-50-29-15-42(4-2)16-30-50/h3-40H,1-2H2.

What are the key properties of 9-[4-(4-ethenylphenoxy)phenyl]-N-[9-[4-(4-ethenylphenoxy)phenyl]-9-(2,3,5,6-tetrafluorophenyl)fluoren-2-yl]-N-(4-fluorophenyl)-9-(2,3,5,6-tetrafluorophenyl)fluoren-2-amine?

9-[4-(4-ethenylphenoxy)phenyl]-N-[9-[4-(4-ethenylphenoxy)phenyl]-9-(2,3,5,6-tetrafluorophenyl)fluoren-2-yl]-N-(4-fluorophenyl)-9-(2,3,5,6-tetrafluorophenyl)fluoren-2-amine has a molecular weight of 1124.12 g/mol, XLogP of 20.01, 13 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for 9-[4-(4-ethenylphenoxy)phenyl]-N-[9-[4-(4-ethenylphenoxy)phenyl]-9-(2,3,5,6-tetrafluorophenyl)fluoren-2-yl]-N-(4-fluorophenyl)-9-(2,3,5,6-tetrafluorophenyl)fluoren-2-amine is sourced from PubChem (CID 167160973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).