9-[7-(2,4-diphenylphenyl)naphthalen-2-yl]-10-naphthalen-1-ylanthracene

C52H34 — CID 123233888

IUPAC9-[7-(2,4-diphenylphenyl)naphthalen-2-yl]-10-naphthalen-1-ylanthracene
SMILESc1ccc(-c2ccc(-c3ccc4ccc(-c5c6ccccc6c(-c6cccc7ccccc67)c6ccccc56)cc4c3)c(-c3ccccc3)c2)cc1
InChIInChI=1S/C52H34/c1-3-14-35(15-4-1)39-30-31-44(50(34-39)38-16-5-2-6-17-38)40-28-26-36-27-29-41(33-42(36)32-40)51-46-21-9-11-23-48(46)52(49-24-12-10-22-47(49)51)45-25-13-19-37-18-7-8-20-43(37)45/h1-34H
InChIKeyIQCMJPVVLLRVEG-UHFFFAOYSA-N
MW658.84 g/mol
LogP14.63
Rot. Bonds5

About 9-[7-(2,4-diphenylphenyl)naphthalen-2-yl]-10-naphthalen-1-ylanthracene

9-[7-(2,4-diphenylphenyl)naphthalen-2-yl]-10-naphthalen-1-ylanthracene (PubChem CID 123233888) has the molecular formula C52H34 and a molecular weight of 658.84 g/mol. Its IUPAC name is 9-[7-(2,4-diphenylphenyl)naphthalen-2-yl]-10-naphthalen-1-ylanthracene.

Molecular Properties

Compound Name9-[7-(2,4-diphenylphenyl)naphthalen-2-yl]-10-naphthalen-1-ylanthracene
PubChem CID123233888
Molecular FormulaC52H34
Molecular Weight658.84 g/mol
Exact Mass658.27
IUPAC Name9-[7-(2,4-diphenylphenyl)naphthalen-2-yl]-10-naphthalen-1-ylanthracene
SMILESc1ccc(-c2ccc(-c3ccc4ccc(-c5c6ccccc6c(-c6cccc7ccccc67)c6ccccc56)cc4c3)c(-c3ccccc3)c2)cc1
InChIInChI=1S/C52H34/c1-3-14-35(15-4-1)39-30-31-44(50(34-39)38-16-5-2-6-17-38)40-28-26-36-27-29-41(33-42(36)32-40)51-46-21-9-11-23-48(46)52(49-24-12-10-22-47(49)51)45-25-13-19-37-18-7-8-20-43(37)45/h1-34H
InChIKeyIQCMJPVVLLRVEG-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

9-naphthalen-1-yl-10-(7-naphthalen-1-ylnaphthalen-2-yl)anthracene;9-naphthalen-1-yl-10-(7-naphthalen-2-ylnaphthalen-2-yl)anthracene;9-(7-naphthalen-1-ylnaphthalen-2-yl)-10-phenylanthracene;9-(7-naphthalen-2-ylnaphthalen-2-yl)-10-phenylanthracene;9-(7-naphthalen-1-ylnaphthalen-2-yl)-10-(2-phenylphenyl)anthracene;9-(7-naphthalen-2-ylnaphthalen-2-yl)-10-(2-phenylphenyl)anthracene;9-naphthalen-1-yl-10-(7-phenylnaphthalen-2-yl)anthracene;9-(7-phenylnaphthalen-2-yl)-10-(2-phenylphenyl)anthracene
CID 163618138
9-naphthalen-1-yl-10-[7-[3-[3-(3-phenylphenyl)phenyl]phenyl]naphthalen-2-yl]anthracene
CID 140855946
9-naphthalen-2-yl-10-(4-naphthalen-2-ylnaphthalen-1-yl)anthracene;9-(6-naphthalen-1-ylnaphthalen-2-yl)-10-phenanthren-1-ylanthracene;9-(6-naphthalen-2-ylnaphthalen-2-yl)-10-phenanthren-1-ylanthracene;9-naphthalen-2-yl-10-phenanthren-1-ylanthracene;9-naphthalen-1-yl-10-(2-phenylphenyl)anthracene;9-phenanthren-1-yl-10-(6-phenylnaphthalen-2-yl)anthracene
CID 160962271
9-[3,4-bis(2-phenylphenyl)phenyl]-10-naphthalen-2-ylanthracene;9-[3,4-bis(3-phenylphenyl)phenyl]-10-naphthalen-2-ylanthracene;9-naphthalen-2-yl-10-[4-(2-phenylphenyl)-3-(3-phenylphenyl)phenyl]anthracene
CID 157150348
9-naphthalen-1-yl-10-(4-naphthalen-1-ylnaphthalen-1-yl)anthracene;9-naphthalen-1-yl-10-(4-naphthalen-2-ylnaphthalen-1-yl)anthracene;9-naphthalen-1-yl-10-(3-phenylnaphthalen-1-yl)anthracene;9-naphthalen-1-yl-10-(4-phenylnaphthalen-2-yl)anthracene;9-naphthalen-1-yl-10-(6-phenylnaphthalen-2-yl)anthracene
CID 158015443
9-(7-phenylnaphthalen-1-yl)-10-(7-phenylnaphthalen-2-yl)anthracene
CID 156677112
9-naphthalen-1-yl-10-(6-naphthalen-1-ylnaphthalen-2-yl)anthracene;9-naphthalen-2-yl-10-(4-naphthalen-2-ylnaphthalen-1-yl)anthracene;9-naphthalen-1-yl-10-(6-phenanthren-9-ylnaphthalen-2-yl)anthracene;9-naphthalen-2-yl-10-(4-phenylnaphthalen-1-yl)anthracene;9-naphthalen-1-yl-10-[6-[2-(4-phenylphenyl)phenyl]naphthalen-2-yl]anthracene
CID 158259921
bis(9-(3-naphthalen-1-ylphenyl)-10-[4-[10-(3-naphthalen-1-ylphenyl)anthracen-9-yl]phenyl]anthracene);9-(4-naphthalen-2-ylphenyl)-10-[4-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]phenyl]anthracene;9-(2-phenylphenyl)-10-[4-[10-(2-phenylphenyl)anthracen-9-yl]phenyl]anthracene;9-[2-(4-phenylphenyl)phenyl]-10-[4-[10-[2-(4-phenylphenyl)phenyl]anthracen-9-yl]phenyl]anthracene
CID 160597374
9-naphthalen-1-yl-10-(4-naphthalen-2-ylphenyl)-2-(2-phenylphenyl)anthracene
CID 140856123
9-naphthalen-1-yl-10-[4-(4-naphthalen-1-ylnaphthalen-1-yl)phenyl]anthracene;9-naphthalen-1-yl-10-[4-(4-naphthalen-2-ylnaphthalen-1-yl)phenyl]anthracene;9-naphthalen-1-yl-10-[4-(6-naphthalen-1-ylnaphthalen-2-yl)phenyl]anthracene;9-naphthalen-1-yl-10-[4-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]anthracene;9-(4-naphthalen-1-ylnaphthalen-1-yl)-10-(4-naphthalen-1-ylphenyl)anthracene;9-(4-naphthalen-2-ylnaphthalen-1-yl)-10-(4-naphthalen-1-ylphenyl)anthracene;9-naphthalen-1-yl-10-[4-(4-phenylnaphthalen-1-yl)phenyl]anthracene;9-naphthalen-1-yl-10-[4-(6-phenylnaphthalen-2-yl)phenyl]anthracene;9-(4-naphthalen-1-ylphenyl)-10-(4-phenylnaphthalen-1-yl)anthracene;9-naphthalen-1-yl-10-[4-(3-phenylphenyl)phenyl]anthracene
CID 159304855
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
9-naphthalen-1-yl-10-(3-naphthalen-1-ylphenyl)anthracene;9-naphthalen-1-yl-10-(3-naphthalen-2-ylphenyl)anthracene;9-naphthalen-1-yl-10-(4-naphthalen-1-ylphenyl)anthracene;9-naphthalen-1-yl-10-(4-naphthalen-2-ylphenyl)anthracene;9-naphthalen-2-yl-10-(3-naphthalen-1-ylphenyl)anthracene;9-naphthalen-2-yl-10-(3-naphthalen-2-ylphenyl)anthracene;9-naphthalen-2-yl-10-(4-naphthalen-1-ylphenyl)anthracene;9-naphthalen-2-yl-10-(4-naphthalen-2-ylphenyl)anthracene
CID 157304390

Frequently Asked Questions

What is the IUPAC name of 9-[7-(2,4-diphenylphenyl)naphthalen-2-yl]-10-naphthalen-1-ylanthracene?
The IUPAC name of 9-[7-(2,4-diphenylphenyl)naphthalen-2-yl]-10-naphthalen-1-ylanthracene (CID 123233888) is 9-[7-(2,4-diphenylphenyl)naphthalen-2-yl]-10-naphthalen-1-ylanthracene.
What is the SMILES notation for 9-[7-(2,4-diphenylphenyl)naphthalen-2-yl]-10-naphthalen-1-ylanthracene?
The canonical SMILES for 9-[7-(2,4-diphenylphenyl)naphthalen-2-yl]-10-naphthalen-1-ylanthracene is c1ccc(-c2ccc(-c3ccc4ccc(-c5c6ccccc6c(-c6cccc7ccccc67)c6ccccc56)cc4c3)c(-c3ccccc3)c2)cc1.
What is the InChIKey of 9-[7-(2,4-diphenylphenyl)naphthalen-2-yl]-10-naphthalen-1-ylanthracene?
The InChIKey is IQCMJPVVLLRVEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C52H34/c1-3-14-35(15-4-1)39-30-31-44(50(34-39)38-16-5-2-6-17-38)40-28-26-36-27-29-41(33-42(36)32-40)51-46-21-9-11-23-48(46)52(49-24-12-10-22-47(49)51)45-25-13-19-37-18-7-8-20-43(37)45/h1-34H.
What are the key properties of 9-[7-(2,4-diphenylphenyl)naphthalen-2-yl]-10-naphthalen-1-ylanthracene?
9-[7-(2,4-diphenylphenyl)naphthalen-2-yl]-10-naphthalen-1-ylanthracene 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-[7-(2,4-diphenylphenyl)naphthalen-2-yl]-10-naphthalen-1-ylanthracene is sourced from PubChem (CID 123233888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).