2-(1,2-dihydronaphthalen-2-yl)-6,10-dinaphthalen-2-yl-9-(4-phenylphenyl)anthracene

C56H38 — CID 59766313

IUPAC2-(1,2-dihydronaphthalen-2-yl)-6,10-dinaphthalen-2-yl-9-(4-phenylphenyl)anthracene
SMILESC1=CC(c2ccc3c(-c4ccc5ccccc5c4)c4cc(-c5ccc6ccccc6c5)ccc4c(-c4ccc(-c5ccccc5)cc4)c3c2)Cc2ccccc21
InChIInChI=1S/C56H38/c1-2-10-37(11-3-1)41-18-23-42(24-19-41)55-51-30-28-49(47-26-21-39-13-5-8-16-44(39)33-47)36-54(51)56(50-27-22-40-14-6-9-17-45(40)34-50)52-31-29-48(35-53(52)55)46-25-20-38-12-4-7-15-43(38)32-46/h1-31,33-36,46H,32H2
InChIKeyDWITXJDKOWINOS-UHFFFAOYSA-N
MW710.92 g/mol
LogP15.32
Rot. Bonds5

About 2-(1,2-dihydronaphthalen-2-yl)-6,10-dinaphthalen-2-yl-9-(4-phenylphenyl)anthracene

2-(1,2-dihydronaphthalen-2-yl)-6,10-dinaphthalen-2-yl-9-(4-phenylphenyl)anthracene (PubChem CID 59766313) has the molecular formula C56H38 and a molecular weight of 710.92 g/mol. Its IUPAC name is 2-(1,2-dihydronaphthalen-2-yl)-6,10-dinaphthalen-2-yl-9-(4-phenylphenyl)anthracene.

Molecular Properties

Compound Name2-(1,2-dihydronaphthalen-2-yl)-6,10-dinaphthalen-2-yl-9-(4-phenylphenyl)anthracene
PubChem CID59766313
Molecular FormulaC56H38
Molecular Weight710.92 g/mol
Exact Mass710.30
IUPAC Name2-(1,2-dihydronaphthalen-2-yl)-6,10-dinaphthalen-2-yl-9-(4-phenylphenyl)anthracene
SMILESC1=CC(c2ccc3c(-c4ccc5ccccc5c4)c4cc(-c5ccc6ccccc6c5)ccc4c(-c4ccc(-c5ccccc5)cc4)c3c2)Cc2ccccc21
InChIInChI=1S/C56H38/c1-2-10-37(11-3-1)41-18-23-42(24-19-41)55-51-30-28-49(47-26-21-39-13-5-8-16-44(39)33-47)36-54(51)56(50-27-22-40-14-6-9-17-45(40)34-50)52-31-29-48(35-53(52)55)46-25-20-38-12-4-7-15-43(38)32-46/h1-31,33-36,46H,32H2
InChIKeyDWITXJDKOWINOS-UHFFFAOYSA-N
XLogP15.32
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms56
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500710.92
LogP ≤ 515.32
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-(6-naphthalen-2-yl-5,6-dihydronaphthalen-2-yl)-10-(6-naphthalen-2-ylnaphthalen-2-yl)anthracene
CID 143848194
9-naphthalen-2-yl-10-phenyl-2,6-bis(4-phenylphenyl)anthracene
CID 123814094
2,6-dinaphthalen-2-yl-9,10-diphenylanthracene;9,10-dinaphthalen-2-yl-2,6-diphenylanthracene;2,6,9,10-tetraphenylanthracene
CID 158610723
10-naphthalen-2-yl-2-(4-naphthalen-2-ylphenyl)-9-phenylanthracene
CID 166566465
2-naphthalen-2-yl-6,9,10-triphenylanthracene
CID 59342692
10-naphthalen-2-yl-9-[6-[6-(10-naphthalen-2-ylanthracen-9-yl)naphthalen-2-yl]naphthalen-2-yl]-2-phenylanthracene
CID 123979436
2,7-bis(9,10-dinaphthalen-2-ylanthracen-2-yl)triphenylene;2,7-bis(9,10-diphenylanthracen-2-yl)triphenylene;2-[4-[4-(9,10-diphenylanthracen-2-yl)phenyl]phenyl]triphenylene
CID 160662323
9-naphthalen-2-yl-2-(3-naphthalen-2-ylphenyl)-10-(4-naphthalen-2-ylphenyl)anthracene
CID 162700922
9,10-dinaphthalen-2-yl-2-(4-naphthalen-2-ylphenyl)anthracene
CID 59136606
5-naphthalen-2-yl-6,10-diphenyl-8,13-bis(4-phenylphenyl)benzo[a]tetracene
CID 123794949
9-(1,2-dihydronaphthalen-2-yl)-2-N,6-N-bis[4-(9,9-dimethylfluoren-2-yl)cyclohexa-1,5-dien-1-yl]-10-naphthalen-2-yl-2-N,6-N-diphenylanthracene-2,6-diamine
CID 89190031
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

Frequently Asked Questions

What is the IUPAC name of 2-(1,2-dihydronaphthalen-2-yl)-6,10-dinaphthalen-2-yl-9-(4-phenylphenyl)anthracene?
The IUPAC name of 2-(1,2-dihydronaphthalen-2-yl)-6,10-dinaphthalen-2-yl-9-(4-phenylphenyl)anthracene (CID 59766313) is 2-(1,2-dihydronaphthalen-2-yl)-6,10-dinaphthalen-2-yl-9-(4-phenylphenyl)anthracene.
What is the SMILES notation for 2-(1,2-dihydronaphthalen-2-yl)-6,10-dinaphthalen-2-yl-9-(4-phenylphenyl)anthracene?
The canonical SMILES for 2-(1,2-dihydronaphthalen-2-yl)-6,10-dinaphthalen-2-yl-9-(4-phenylphenyl)anthracene is C1=CC(c2ccc3c(-c4ccc5ccccc5c4)c4cc(-c5ccc6ccccc6c5)ccc4c(-c4ccc(-c5ccccc5)cc4)c3c2)Cc2ccccc21.
What is the InChIKey of 2-(1,2-dihydronaphthalen-2-yl)-6,10-dinaphthalen-2-yl-9-(4-phenylphenyl)anthracene?
The InChIKey is DWITXJDKOWINOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C56H38/c1-2-10-37(11-3-1)41-18-23-42(24-19-41)55-51-30-28-49(47-26-21-39-13-5-8-16-44(39)33-47)36-54(51)56(50-27-22-40-14-6-9-17-45(40)34-50)52-31-29-48(35-53(52)55)46-25-20-38-12-4-7-15-43(38)32-46/h1-31,33-36,46H,32H2.
What are the key properties of 2-(1,2-dihydronaphthalen-2-yl)-6,10-dinaphthalen-2-yl-9-(4-phenylphenyl)anthracene?
2-(1,2-dihydronaphthalen-2-yl)-6,10-dinaphthalen-2-yl-9-(4-phenylphenyl)anthracene has a molecular weight of 710.92 g/mol, XLogP of 15.32, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,2-dihydronaphthalen-2-yl)-6,10-dinaphthalen-2-yl-9-(4-phenylphenyl)anthracene is sourced from PubChem (CID 59766313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).