9,9-dinaphthalen-2-yl-2,7-bis(4-phenylphenyl)fluorene

C57H38 — CID 144772685

IUPAC9,9-dinaphthalen-2-yl-2,7-bis(4-phenylphenyl)fluorene
SMILESc1ccc(-c2ccc(-c3ccc4c(c3)C(c3ccc5ccccc5c3)(c3ccc5ccccc5c3)c3cc(-c5ccc(-c6ccccc6)cc5)ccc3-4)cc2)cc1
InChIInChI=1S/C57H38/c1-3-11-39(12-4-1)43-19-23-45(24-20-43)49-29-33-53-54-34-30-50(46-25-21-44(22-26-46)40-13-5-2-6-14-40)38-56(54)57(55(53)37-49,51-31-27-41-15-7-9-17-47(41)35-51)52-32-28-42-16-8-10-18-48(42)36-52/h1-38H
InChIKeyKOPBNUPPXUWKRX-UHFFFAOYSA-N
MW722.93 g/mol
LogP15.02
Rot. Bonds6

About 9,9-dinaphthalen-2-yl-2,7-bis(4-phenylphenyl)fluorene

9,9-dinaphthalen-2-yl-2,7-bis(4-phenylphenyl)fluorene (PubChem CID 144772685) has the molecular formula C57H38 and a molecular weight of 722.93 g/mol. Its IUPAC name is 9,9-dinaphthalen-2-yl-2,7-bis(4-phenylphenyl)fluorene.

Molecular Properties

Compound Name9,9-dinaphthalen-2-yl-2,7-bis(4-phenylphenyl)fluorene
PubChem CID144772685
Molecular FormulaC57H38
Molecular Weight722.93 g/mol
Exact Mass722.30
IUPAC Name9,9-dinaphthalen-2-yl-2,7-bis(4-phenylphenyl)fluorene
SMILESc1ccc(-c2ccc(-c3ccc4c(c3)C(c3ccc5ccccc5c3)(c3ccc5ccccc5c3)c3cc(-c5ccc(-c6ccccc6)cc5)ccc3-4)cc2)cc1
InChIInChI=1S/C57H38/c1-3-11-39(12-4-1)43-19-23-45(24-20-43)49-29-33-53-54-34-30-50(46-25-21-44(22-26-46)40-13-5-2-6-14-40)38-56(54)57(55(53)37-49,51-31-27-41-15-7-9-17-47(41)35-51)52-32-28-42-16-8-10-18-48(42)36-52/h1-38H
InChIKeyKOPBNUPPXUWKRX-UHFFFAOYSA-N
XLogP15.02
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms57
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500722.93
LogP ≤ 515.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

2,9,9-trinaphthalen-2-ylfluorene
CID 144772576
9-[4-(4-methylphenyl)phenyl]-2,7-dinaphthalen-2-yl-9-phenylfluorene
CID 58894843
2-[3-(3-naphthalen-2-ylphenyl)phenyl]-9,9-diphenylfluorene
CID 154591120
4-[4-(9,9-dinaphthalen-2-ylfluoren-2-yl)naphthalen-1-yl]-2-phenyl-6-(4-phenylphenyl)pyrimidine
CID 168778935
9-[4-(4-methylphenyl)phenyl]-9-phenyl-2,7-bis(4-phenylphenyl)fluorene
CID 58894820
N-[4-(9,9-diphenylfluoren-2-yl)phenyl]-N-[4-[3-(3-naphthalen-2-ylphenyl)phenyl]phenyl]-4-phenylaniline
CID 166566152
2-[3-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]-9,9'-spirobi[fluorene]
CID 140710700
N-[4-(9,9-diphenylfluoren-2-yl)phenyl]-4-[3-(3-naphthalen-2-ylphenyl)phenyl]-N-phenylaniline
CID 166566284
9,9-dimethyl-2-naphthalen-2-yl-7-[3-(4-phenylphenyl)phenyl]fluorene
CID 59217136
2-[9,9-dimethyl-7-(6-naphthalen-2-ylnaphthalen-2-yl)fluoren-2-yl]-9,9-dimethyl-7-(3-phenylphenyl)fluorene
CID 123207992
N-[4-(9,9-diphenylfluoren-2-yl)phenyl]-N-phenylnaphthalen-2-amine
CID 58988737
9,9-diphenyl-2-[3-(3-phenylphenyl)phenyl]fluorene
CID 154591168

Frequently Asked Questions

What is the IUPAC name of 9,9-dinaphthalen-2-yl-2,7-bis(4-phenylphenyl)fluorene?
The IUPAC name of 9,9-dinaphthalen-2-yl-2,7-bis(4-phenylphenyl)fluorene (CID 144772685) is 9,9-dinaphthalen-2-yl-2,7-bis(4-phenylphenyl)fluorene.
What is the SMILES notation for 9,9-dinaphthalen-2-yl-2,7-bis(4-phenylphenyl)fluorene?
The canonical SMILES for 9,9-dinaphthalen-2-yl-2,7-bis(4-phenylphenyl)fluorene is c1ccc(-c2ccc(-c3ccc4c(c3)C(c3ccc5ccccc5c3)(c3ccc5ccccc5c3)c3cc(-c5ccc(-c6ccccc6)cc5)ccc3-4)cc2)cc1.
What is the InChIKey of 9,9-dinaphthalen-2-yl-2,7-bis(4-phenylphenyl)fluorene?
The InChIKey is KOPBNUPPXUWKRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C57H38/c1-3-11-39(12-4-1)43-19-23-45(24-20-43)49-29-33-53-54-34-30-50(46-25-21-44(22-26-46)40-13-5-2-6-14-40)38-56(54)57(55(53)37-49,51-31-27-41-15-7-9-17-47(41)35-51)52-32-28-42-16-8-10-18-48(42)36-52/h1-38H.
What are the key properties of 9,9-dinaphthalen-2-yl-2,7-bis(4-phenylphenyl)fluorene?
9,9-dinaphthalen-2-yl-2,7-bis(4-phenylphenyl)fluorene has a molecular weight of 722.93 g/mol, XLogP of 15.02, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9,9-dinaphthalen-2-yl-2,7-bis(4-phenylphenyl)fluorene is sourced from PubChem (CID 144772685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).