9-(4-ethylphenyl)-9-phenylfluorene

C27H22 — CID 149284542

IUPAC9-(4-ethylphenyl)-9-phenylfluorene
SMILESCCc1ccc(C2(c3ccccc3)c3ccccc3-c3ccccc32)cc1
InChIInChI=1S/C27H22/c1-2-20-16-18-22(19-17-20)27(21-10-4-3-5-11-21)25-14-8-6-12-23(25)24-13-7-9-15-26(24)27/h3-19H,2H2,1H3
InChIKeyXTPNPUPJUPXZPJ-UHFFFAOYSA-N
MW346.47 g/mol
LogP6.61
Rot. Bonds3

About 9-(4-ethylphenyl)-9-phenylfluorene

9-(4-ethylphenyl)-9-phenylfluorene (PubChem CID 149284542) has the molecular formula C27H22 and a molecular weight of 346.47 g/mol. Its IUPAC name is 9-(4-ethylphenyl)-9-phenylfluorene.

Molecular Properties

Compound Name9-(4-ethylphenyl)-9-phenylfluorene
PubChem CID149284542
Molecular FormulaC27H22
Molecular Weight346.47 g/mol
Exact Mass346.17
IUPAC Name9-(4-ethylphenyl)-9-phenylfluorene
SMILESCCc1ccc(C2(c3ccccc3)c3ccccc3-c3ccccc32)cc1
InChIInChI=1S/C27H22/c1-2-20-16-18-22(19-17-20)27(21-10-4-3-5-11-21)25-14-8-6-12-23(25)24-13-7-9-15-26(24)27/h3-19H,2H2,1H3
InChIKeyXTPNPUPJUPXZPJ-UHFFFAOYSA-N
XLogP6.61
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms27
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500346.47
LogP ≤ 56.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 9-(4-ethylphenyl)-9-phenylfluorene?
The IUPAC name of 9-(4-ethylphenyl)-9-phenylfluorene (CID 149284542) is 9-(4-ethylphenyl)-9-phenylfluorene.
What is the SMILES notation for 9-(4-ethylphenyl)-9-phenylfluorene?
The canonical SMILES for 9-(4-ethylphenyl)-9-phenylfluorene is CCc1ccc(C2(c3ccccc3)c3ccccc3-c3ccccc32)cc1.
What is the InChIKey of 9-(4-ethylphenyl)-9-phenylfluorene?
The InChIKey is XTPNPUPJUPXZPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H22/c1-2-20-16-18-22(19-17-20)27(21-10-4-3-5-11-21)25-14-8-6-12-23(25)24-13-7-9-15-26(24)27/h3-19H,2H2,1H3.
What are the key properties of 9-(4-ethylphenyl)-9-phenylfluorene?
9-(4-ethylphenyl)-9-phenylfluorene has a molecular weight of 346.47 g/mol, XLogP of 6.61, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(4-ethylphenyl)-9-phenylfluorene is sourced from PubChem (CID 149284542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).