9-[5-(9H-fluoren-9-yl)octan-4-yl]-9H-fluorene

C34H34 — CID 19706069

IUPAC9-[5-(9H-fluoren-9-yl)octan-4-yl]-9H-fluorene
SMILESCCCC(C1c2ccccc2-c2ccccc21)C(CCC)C1c2ccccc2-c2ccccc21
InChIInChI=1S/C34H34/c1-3-13-27(33-29-19-9-5-15-23(29)24-16-6-10-20-30(24)33)28(14-4-2)34-31-21-11-7-17-25(31)26-18-8-12-22-32(26)34/h5-12,15-22,27-28,33-34H,3-4,13-14H2,1-2H3
InChIKeyLILWZKDFKCHHQL-UHFFFAOYSA-N
MW442.65 g/mol
LogP9.44
Rot. Bonds7

About 9-[5-(9H-fluoren-9-yl)octan-4-yl]-9H-fluorene

9-[5-(9H-fluoren-9-yl)octan-4-yl]-9H-fluorene (PubChem CID 19706069) has the molecular formula C34H34 and a molecular weight of 442.65 g/mol. Its IUPAC name is 9-[5-(9H-fluoren-9-yl)octan-4-yl]-9H-fluorene.

Molecular Properties

Compound Name9-[5-(9H-fluoren-9-yl)octan-4-yl]-9H-fluorene
PubChem CID19706069
Molecular FormulaC34H34
Molecular Weight442.65 g/mol
Exact Mass442.27
IUPAC Name9-[5-(9H-fluoren-9-yl)octan-4-yl]-9H-fluorene
SMILESCCCC(C1c2ccccc2-c2ccccc21)C(CCC)C1c2ccccc2-c2ccccc21
InChIInChI=1S/C34H34/c1-3-13-27(33-29-19-9-5-15-23(29)24-16-6-10-20-30(24)33)28(14-4-2)34-31-21-11-7-17-25(31)26-18-8-12-22-32(26)34/h5-12,15-22,27-28,33-34H,3-4,13-14H2,1-2H3
InChIKeyLILWZKDFKCHHQL-UHFFFAOYSA-N
XLogP9.44
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500442.65
LogP ≤ 59.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 9-[5-(9H-fluoren-9-yl)octan-4-yl]-9H-fluorene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 9-[5-(9H-fluoren-9-yl)octan-4-yl]-9H-fluorene?
The IUPAC name of 9-[5-(9H-fluoren-9-yl)octan-4-yl]-9H-fluorene (CID 19706069) is 9-[5-(9H-fluoren-9-yl)octan-4-yl]-9H-fluorene.
What is the SMILES notation for 9-[5-(9H-fluoren-9-yl)octan-4-yl]-9H-fluorene?
The canonical SMILES for 9-[5-(9H-fluoren-9-yl)octan-4-yl]-9H-fluorene is CCCC(C1c2ccccc2-c2ccccc21)C(CCC)C1c2ccccc2-c2ccccc21.
What is the InChIKey of 9-[5-(9H-fluoren-9-yl)octan-4-yl]-9H-fluorene?
The InChIKey is LILWZKDFKCHHQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H34/c1-3-13-27(33-29-19-9-5-15-23(29)24-16-6-10-20-30(24)33)28(14-4-2)34-31-21-11-7-17-25(31)26-18-8-12-22-32(26)34/h5-12,15-22,27-28,33-34H,3-4,13-14H2,1-2H3.
What are the key properties of 9-[5-(9H-fluoren-9-yl)octan-4-yl]-9H-fluorene?
9-[5-(9H-fluoren-9-yl)octan-4-yl]-9H-fluorene has a molecular weight of 442.65 g/mol, XLogP of 9.44, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[5-(9H-fluoren-9-yl)octan-4-yl]-9H-fluorene is sourced from PubChem (CID 19706069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).