9-phenyl-9-(9-phenylfluoren-9-yl)fluorene

C38H26 — CID 11283071

IUPAC9-phenyl-9-(9-phenylfluoren-9-yl)fluorene
SMILESc1ccc(C2(C3(c4ccccc4)c4ccccc4-c4ccccc43)c3ccccc3-c3ccccc32)cc1
InChIInChI=1S/C38H26/c1-3-15-27(16-4-1)37(33-23-11-7-19-29(33)30-20-8-12-24-34(30)37)38(28-17-5-2-6-18-28)35-25-13-9-21-31(35)32-22-10-14-26-36(32)38/h1-26H
InChIKeyQURWPQKEBZVHBT-UHFFFAOYSA-N
MW482.63 g/mol
LogP9.02
Rot. Bonds3

About 9-phenyl-9-(9-phenylfluoren-9-yl)fluorene

9-phenyl-9-(9-phenylfluoren-9-yl)fluorene (PubChem CID 11283071) has the molecular formula C38H26 and a molecular weight of 482.63 g/mol. Its IUPAC name is 9-phenyl-9-(9-phenylfluoren-9-yl)fluorene.

Molecular Properties

Compound Name9-phenyl-9-(9-phenylfluoren-9-yl)fluorene
PubChem CID11283071
Molecular FormulaC38H26
Molecular Weight482.63 g/mol
Exact Mass482.20
IUPAC Name9-phenyl-9-(9-phenylfluoren-9-yl)fluorene
SMILESc1ccc(C2(C3(c4ccccc4)c4ccccc4-c4ccccc43)c3ccccc3-c3ccccc32)cc1
InChIInChI=1S/C38H26/c1-3-15-27(16-4-1)37(33-23-11-7-19-29(33)30-20-8-12-24-34(30)37)38(28-17-5-2-6-18-28)35-25-13-9-21-31(35)32-22-10-14-26-36(32)38/h1-26H
InChIKeyQURWPQKEBZVHBT-UHFFFAOYSA-N
XLogP9.02
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms38
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500482.63
LogP ≤ 59.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 9-phenyl-9-(9-phenylfluoren-9-yl)fluorene?
The IUPAC name of 9-phenyl-9-(9-phenylfluoren-9-yl)fluorene (CID 11283071) is 9-phenyl-9-(9-phenylfluoren-9-yl)fluorene.
What is the SMILES notation for 9-phenyl-9-(9-phenylfluoren-9-yl)fluorene?
The canonical SMILES for 9-phenyl-9-(9-phenylfluoren-9-yl)fluorene is c1ccc(C2(C3(c4ccccc4)c4ccccc4-c4ccccc43)c3ccccc3-c3ccccc32)cc1.
What is the InChIKey of 9-phenyl-9-(9-phenylfluoren-9-yl)fluorene?
The InChIKey is QURWPQKEBZVHBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C38H26/c1-3-15-27(16-4-1)37(33-23-11-7-19-29(33)30-20-8-12-24-34(30)37)38(28-17-5-2-6-18-28)35-25-13-9-21-31(35)32-22-10-14-26-36(32)38/h1-26H.
What are the key properties of 9-phenyl-9-(9-phenylfluoren-9-yl)fluorene?
9-phenyl-9-(9-phenylfluoren-9-yl)fluorene has a molecular weight of 482.63 g/mol, XLogP of 9.02, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9-phenyl-9-(9-phenylfluoren-9-yl)fluorene is sourced from PubChem (CID 11283071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).