9-naphthalen-1-yl-10-(4-naphthalen-2-ylphenyl)-2-(2-phenylphenyl)anthracene

C52H34 — CID 140856123

IUPAC9-naphthalen-1-yl-10-(4-naphthalen-2-ylphenyl)-2-(2-phenylphenyl)anthracene
SMILESc1ccc(-c2ccccc2-c2ccc3c(-c4ccc(-c5ccc6ccccc6c5)cc4)c4ccccc4c(-c4cccc5ccccc45)c3c2)cc1
InChIInChI=1S/C52H34/c1-2-14-37(15-3-1)43-19-8-9-21-45(43)42-31-32-49-50(34-42)52(46-24-12-18-38-16-6-7-20-44(38)46)48-23-11-10-22-47(48)51(49)39-28-25-36(26-29-39)41-30-27-35-13-4-5-17-40(35)33-41/h1-34H
InChIKeyAYKJWVICWPKGCN-UHFFFAOYSA-N
MW658.84 g/mol
LogP14.63
Rot. Bonds5

About 9-naphthalen-1-yl-10-(4-naphthalen-2-ylphenyl)-2-(2-phenylphenyl)anthracene

9-naphthalen-1-yl-10-(4-naphthalen-2-ylphenyl)-2-(2-phenylphenyl)anthracene (PubChem CID 140856123) has the molecular formula C52H34 and a molecular weight of 658.84 g/mol. Its IUPAC name is 9-naphthalen-1-yl-10-(4-naphthalen-2-ylphenyl)-2-(2-phenylphenyl)anthracene.

Molecular Properties

Compound Name9-naphthalen-1-yl-10-(4-naphthalen-2-ylphenyl)-2-(2-phenylphenyl)anthracene
PubChem CID140856123
Molecular FormulaC52H34
Molecular Weight658.84 g/mol
Exact Mass658.27
IUPAC Name9-naphthalen-1-yl-10-(4-naphthalen-2-ylphenyl)-2-(2-phenylphenyl)anthracene
SMILESc1ccc(-c2ccccc2-c2ccc3c(-c4ccc(-c5ccc6ccccc6c5)cc4)c4ccccc4c(-c4cccc5ccccc45)c3c2)cc1
InChIInChI=1S/C52H34/c1-2-14-37(15-3-1)43-19-8-9-21-45(43)42-31-32-49-50(34-42)52(46-24-12-18-38-16-6-7-20-44(38)46)48-23-11-10-22-47(48)51(49)39-28-25-36(26-29-39)41-30-27-35-13-4-5-17-40(35)33-41/h1-34H
InChIKeyAYKJWVICWPKGCN-UHFFFAOYSA-N
XLogP14.63
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms52
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500658.84
LogP ≤ 514.63
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

10-naphthalen-1-yl-9-(4-naphthalen-2-ylphenyl)-2-phenylanthracene
CID 58322799
9,10-bis(4-phenylphenyl)-2-[10-(4-phenylphenyl)anthracen-9-yl]anthracene;10-naphthalen-1-yl-2-(4-naphthalen-1-ylphenyl)-9-phenylanthracene;10-naphthalen-2-yl-2-(4-naphthalen-1-ylphenyl)-9-phenylanthracene
CID 157246826
9,10-dinaphthalen-1-yl-2-phenylanthracene;2-naphthalen-2-yl-9,10-diphenylanthracene;10-naphthalen-1-yl-2-naphthalen-2-yl-9-phenylanthracene;9-naphthalen-1-yl-2-phenyl-10-(4-phenylphenyl)anthracene;9-naphthalen-2-yl-2-phenyl-10-(4-phenylphenyl)anthracene;2-phenyl-9,10-bis(4-phenylphenyl)anthracene
CID 161337169
9-naphthalen-1-yl-10-(4-naphthalen-1-ylnaphthalen-1-yl)anthracene;9-(4-naphthalen-2-ylnaphthalen-1-yl)-10-phenylanthracene;9-naphthalen-1-yl-10-(4-naphthalen-2-ylphenyl)-2-(2-phenylphenyl)anthracene;9-naphthalen-1-yl-10-[6-[3-(3-phenylphenyl)phenyl]naphthalen-2-yl]anthracene;9-phenyl-10-[4-(3-phenylphenyl)naphthalen-1-yl]anthracene
CID 160566429
2-naphthalen-1-yl-9-(3-naphthalen-1-ylphenyl)-10-(4-naphthalen-1-ylphenyl)anthracene;2-naphthalen-1-yl-9-(3-naphthalen-2-ylphenyl)-10-(4-naphthalen-1-ylphenyl)anthracene;2-naphthalen-1-yl-9-(4-naphthalen-1-ylphenyl)-10-(2-phenylphenyl)anthracene;2-naphthalen-1-yl-10-(4-naphthalen-1-ylphenyl)-9-(4-phenylphenyl)anthracene
CID 159983739
2-naphthalen-1-yl-10-(4-naphthalen-1-ylphenyl)-9-phenylanthracene;2-naphthalen-1-yl-10-(4-naphthalen-2-ylphenyl)-9-phenylanthracene;2-naphthalen-2-yl-10-(4-naphthalen-2-ylphenyl)-9-phenylanthracene;9-phenyl-10-[4-(3-phenylphenyl)phenyl]anthracene;9-phenyl-10-[4-[3-(3-phenylphenyl)phenyl]phenyl]anthracene
CID 158805732
10-naphthalen-1-yl-9-naphthalen-2-yl-2-(4-phenylphenyl)anthracene
CID 59766348
9-naphthalen-1-yl-10-naphthalen-2-yl-2,6-diphenylanthracene
CID 123330330
10-naphthalen-1-yl-2-naphthalen-2-yl-9-(2-phenylphenyl)anthracene
CID 58323519
10-naphthalen-1-yl-2-naphthalen-2-yl-9-(4-naphthalen-2-ylphenyl)anthracene
CID 58193908
9-naphthalen-1-yl-2,6-dinaphthalen-2-yl-10-(4-naphthalen-2-ylphenyl)anthracene
CID 159201170
9-[6-(3-naphthalen-2-ylphenyl)naphthalen-1-yl]-10-phenylanthracene;9-(2-naphthalen-2-ylphenyl)-10-phenylanthracene;9-(4-naphthalen-1-ylphenyl)-10-phenylanthracene;9-(4-naphthalen-2-ylphenyl)-10-phenylanthracene
CID 165002547

Frequently Asked Questions

What is the IUPAC name of 9-naphthalen-1-yl-10-(4-naphthalen-2-ylphenyl)-2-(2-phenylphenyl)anthracene?
The IUPAC name of 9-naphthalen-1-yl-10-(4-naphthalen-2-ylphenyl)-2-(2-phenylphenyl)anthracene (CID 140856123) is 9-naphthalen-1-yl-10-(4-naphthalen-2-ylphenyl)-2-(2-phenylphenyl)anthracene.
What is the SMILES notation for 9-naphthalen-1-yl-10-(4-naphthalen-2-ylphenyl)-2-(2-phenylphenyl)anthracene?
The canonical SMILES for 9-naphthalen-1-yl-10-(4-naphthalen-2-ylphenyl)-2-(2-phenylphenyl)anthracene is c1ccc(-c2ccccc2-c2ccc3c(-c4ccc(-c5ccc6ccccc6c5)cc4)c4ccccc4c(-c4cccc5ccccc45)c3c2)cc1.
What is the InChIKey of 9-naphthalen-1-yl-10-(4-naphthalen-2-ylphenyl)-2-(2-phenylphenyl)anthracene?
The InChIKey is AYKJWVICWPKGCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C52H34/c1-2-14-37(15-3-1)43-19-8-9-21-45(43)42-31-32-49-50(34-42)52(46-24-12-18-38-16-6-7-20-44(38)46)48-23-11-10-22-47(48)51(49)39-28-25-36(26-29-39)41-30-27-35-13-4-5-17-40(35)33-41/h1-34H.
What are the key properties of 9-naphthalen-1-yl-10-(4-naphthalen-2-ylphenyl)-2-(2-phenylphenyl)anthracene?
9-naphthalen-1-yl-10-(4-naphthalen-2-ylphenyl)-2-(2-phenylphenyl)anthracene has a molecular weight of 658.84 g/mol, XLogP of 14.63, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9-naphthalen-1-yl-10-(4-naphthalen-2-ylphenyl)-2-(2-phenylphenyl)anthracene is sourced from PubChem (CID 140856123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).