9-(9-phenylfluoren-9-yl)anthracene

C33H22 — CID 174477278

IUPAC9-(9-phenylfluoren-9-yl)anthracene
SMILESc1ccc(C2(c3c4ccccc4cc4ccccc34)c3ccccc3-c3ccccc32)cc1
InChIInChI=1S/C33H22/c1-2-14-25(15-3-1)33(30-20-10-8-18-28(30)29-19-9-11-21-31(29)33)32-26-16-6-4-12-23(26)22-24-13-5-7-17-27(24)32/h1-22H
InChIKeyISCBFGPPMJGPGR-UHFFFAOYSA-N
MW418.54 g/mol
LogP8.36
Rot. Bonds2

About 9-(9-phenylfluoren-9-yl)anthracene

9-(9-phenylfluoren-9-yl)anthracene (PubChem CID 174477278) has the molecular formula C33H22 and a molecular weight of 418.54 g/mol. Its IUPAC name is 9-(9-phenylfluoren-9-yl)anthracene.

Molecular Properties

Compound Name9-(9-phenylfluoren-9-yl)anthracene
PubChem CID174477278
Molecular FormulaC33H22
Molecular Weight418.54 g/mol
Exact Mass418.17
IUPAC Name9-(9-phenylfluoren-9-yl)anthracene
SMILESc1ccc(C2(c3c4ccccc4cc4ccccc34)c3ccccc3-c3ccccc32)cc1
InChIInChI=1S/C33H22/c1-2-14-25(15-3-1)33(30-20-10-8-18-28(30)29-19-9-11-21-31(29)33)32-26-16-6-4-12-23(26)22-24-13-5-7-17-27(24)32/h1-22H
InChIKeyISCBFGPPMJGPGR-UHFFFAOYSA-N
XLogP8.36
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500418.54
LogP ≤ 58.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Related Compounds

1-(3-methylnaphthalen-1-yl)-9,9-diphenylfluorene
CID 170522173
9-[4-[4-(9-phenylfluoren-9-yl)phenyl]phenyl]phenanthrene
CID 123590616
3-phenanthren-9-yl-11,11-diphenylbenzo[a]fluorene
CID 166034552
2-naphthalen-1-yl-9,9-diphenylfluorene;hydroiodide
CID 144939232
9-anthracen-9-ylfluoren-9-ol
CID 72942304
9,9-diphenylfluorene;methane
CID 145140147
9,9-diphenylfluorene;methane
CID 145331804
2-(11,11-diphenylbenzo[a]fluoren-6-yl)-4,6-diphenyl-1,3,5-triazine
CID 165152070
3-(3,5-dinaphthalen-2-ylphenyl)-11,11-diphenylbenzo[a]fluorene
CID 166034195
9-[4-[3-[9-[3-(4-anthracen-9-ylphenyl)phenyl]fluoren-9-yl]phenyl]phenyl]anthracene
CID 123659386
9-[3-[3-[9-[3-(3-anthracen-9-ylphenyl)phenyl]fluoren-9-yl]phenyl]phenyl]anthracene;9-[3-[4-[9-[4-(3-anthracen-9-ylphenyl)phenyl]fluoren-9-yl]phenyl]phenyl]anthracene;9-[4-[3-[9-[3-(4-anthracen-9-ylphenyl)phenyl]fluoren-9-yl]phenyl]phenyl]anthracene
CID 159639857
9,9-dinaphthalen-1-ylfluorene
CID 140680296

Frequently Asked Questions

What is the IUPAC name of 9-(9-phenylfluoren-9-yl)anthracene?
The IUPAC name of 9-(9-phenylfluoren-9-yl)anthracene (CID 174477278) is 9-(9-phenylfluoren-9-yl)anthracene.
What is the SMILES notation for 9-(9-phenylfluoren-9-yl)anthracene?
The canonical SMILES for 9-(9-phenylfluoren-9-yl)anthracene is c1ccc(C2(c3c4ccccc4cc4ccccc34)c3ccccc3-c3ccccc32)cc1.
What is the InChIKey of 9-(9-phenylfluoren-9-yl)anthracene?
The InChIKey is ISCBFGPPMJGPGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H22/c1-2-14-25(15-3-1)33(30-20-10-8-18-28(30)29-19-9-11-21-31(29)33)32-26-16-6-4-12-23(26)22-24-13-5-7-17-27(24)32/h1-22H.
What are the key properties of 9-(9-phenylfluoren-9-yl)anthracene?
9-(9-phenylfluoren-9-yl)anthracene has a molecular weight of 418.54 g/mol, XLogP of 8.36, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(9-phenylfluoren-9-yl)anthracene is sourced from PubChem (CID 174477278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).