9-phenyl-3-(4-propan-2-ylcyclopent-2-en-1-yl)-9H-fluorene

C27H26 — CID 140637782

IUPAC9-phenyl-3-(4-propan-2-ylcyclopent-2-en-1-yl)-9H-fluorene
SMILESCC(C)C1C=CC(c2ccc3c(c2)-c2ccccc2C3c2ccccc2)C1
InChIInChI=1S/C27H26/c1-18(2)20-12-13-21(16-20)22-14-15-25-26(17-22)23-10-6-7-11-24(23)27(25)19-8-4-3-5-9-19/h3-15,17-18,20-21,27H,16H2,1-2H3
InChIKeyLFCBVDMZKMIFEJ-UHFFFAOYSA-N
MW350.50 g/mol
LogP7.16
Rot. Bonds3

About 9-phenyl-3-(4-propan-2-ylcyclopent-2-en-1-yl)-9H-fluorene

9-phenyl-3-(4-propan-2-ylcyclopent-2-en-1-yl)-9H-fluorene (PubChem CID 140637782) has the molecular formula C27H26 and a molecular weight of 350.50 g/mol. Its IUPAC name is 9-phenyl-3-(4-propan-2-ylcyclopent-2-en-1-yl)-9H-fluorene.

Molecular Properties

Compound Name9-phenyl-3-(4-propan-2-ylcyclopent-2-en-1-yl)-9H-fluorene
PubChem CID140637782
Molecular FormulaC27H26
Molecular Weight350.50 g/mol
Exact Mass350.20
IUPAC Name9-phenyl-3-(4-propan-2-ylcyclopent-2-en-1-yl)-9H-fluorene
SMILESCC(C)C1C=CC(c2ccc3c(c2)-c2ccccc2C3c2ccccc2)C1
InChIInChI=1S/C27H26/c1-18(2)20-12-13-21(16-20)22-14-15-25-26(17-22)23-10-6-7-11-24(23)27(25)19-8-4-3-5-9-19/h3-15,17-18,20-21,27H,16H2,1-2H3
InChIKeyLFCBVDMZKMIFEJ-UHFFFAOYSA-N
XLogP7.16
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500350.50
LogP ≤ 57.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

9-phenyl-9H-fluorene
CID 13091
9-(4-propan-2-ylphenyl)-9H-fluorene
CID 123721477
9-[4-[4-[4-(9H-fluoren-9-yl)-2-phenylphenyl]phenyl]phenyl]-9H-fluorene
CID 58556038
9-[4-[3-[3-[4-(3,5-diphenylphenyl)phenyl]phenyl]phenyl]phenyl]-9H-fluorene
CID 58556073
10-(4-phenylphenyl)-2-propan-2-yl-10H-anthracen-9-one
CID 145450986
10-[3-(3,5-diphenylphenyl)phenyl]-8,12-diphenyl-10,12-dihydroindeno[2,1-b]fluorene
CID 158775049
9-phenyl-9H-fluoren-2-ol
CID 69029372
2-[9-[2-(9H-fluoren-4-yl)phenyl]-9H-fluoren-3-yl]-9-phenyl-9H-fluorene
CID 159754601
[3-(9H-fluoren-9-yl)phenyl]methanol
CID 174755299
9-[3-(9H-fluoren-9-yl)phenyl]-9-phenylfluorene
CID 123461453
7,14-diphenyl-7,14-dihydropentacene-5,12-dione
CID 23522309
9-[4-[4-[4-(9H-fluoren-9-yl)phenyl]-2-phenylphenyl]phenyl]-9H-fluorene
CID 58556035

Frequently Asked Questions

What is the IUPAC name of 9-phenyl-3-(4-propan-2-ylcyclopent-2-en-1-yl)-9H-fluorene?
The IUPAC name of 9-phenyl-3-(4-propan-2-ylcyclopent-2-en-1-yl)-9H-fluorene (CID 140637782) is 9-phenyl-3-(4-propan-2-ylcyclopent-2-en-1-yl)-9H-fluorene.
What is the SMILES notation for 9-phenyl-3-(4-propan-2-ylcyclopent-2-en-1-yl)-9H-fluorene?
The canonical SMILES for 9-phenyl-3-(4-propan-2-ylcyclopent-2-en-1-yl)-9H-fluorene is CC(C)C1C=CC(c2ccc3c(c2)-c2ccccc2C3c2ccccc2)C1.
What is the InChIKey of 9-phenyl-3-(4-propan-2-ylcyclopent-2-en-1-yl)-9H-fluorene?
The InChIKey is LFCBVDMZKMIFEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H26/c1-18(2)20-12-13-21(16-20)22-14-15-25-26(17-22)23-10-6-7-11-24(23)27(25)19-8-4-3-5-9-19/h3-15,17-18,20-21,27H,16H2,1-2H3.
What are the key properties of 9-phenyl-3-(4-propan-2-ylcyclopent-2-en-1-yl)-9H-fluorene?
9-phenyl-3-(4-propan-2-ylcyclopent-2-en-1-yl)-9H-fluorene has a molecular weight of 350.50 g/mol, XLogP of 7.16, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9-phenyl-3-(4-propan-2-ylcyclopent-2-en-1-yl)-9H-fluorene is sourced from PubChem (CID 140637782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).