9-(4-phenylnaphthalen-1-yl)-10-(4-phenylphenyl)anthracene

C42H28 — CID 123739520

IUPAC9-(4-phenylnaphthalen-1-yl)-10-(4-phenylphenyl)anthracene
SMILESc1ccc(-c2ccc(-c3c4ccccc4c(-c4ccc(-c5ccccc5)c5ccccc45)c4ccccc34)cc2)cc1
InChIInChI=1S/C42H28/c1-3-13-29(14-4-1)30-23-25-32(26-24-30)41-36-19-9-11-21-38(36)42(39-22-12-10-20-37(39)41)40-28-27-33(31-15-5-2-6-16-31)34-17-7-8-18-35(34)40/h1-28H
InChIKeyJDUHGLFLQKBWDW-UHFFFAOYSA-N
MW532.69 g/mol
LogP11.81
Rot. Bonds4

About 9-(4-phenylnaphthalen-1-yl)-10-(4-phenylphenyl)anthracene

9-(4-phenylnaphthalen-1-yl)-10-(4-phenylphenyl)anthracene (PubChem CID 123739520) has the molecular formula C42H28 and a molecular weight of 532.69 g/mol. Its IUPAC name is 9-(4-phenylnaphthalen-1-yl)-10-(4-phenylphenyl)anthracene.

Molecular Properties

Compound Name9-(4-phenylnaphthalen-1-yl)-10-(4-phenylphenyl)anthracene
PubChem CID123739520
Molecular FormulaC42H28
Molecular Weight532.69 g/mol
Exact Mass532.22
IUPAC Name9-(4-phenylnaphthalen-1-yl)-10-(4-phenylphenyl)anthracene
SMILESc1ccc(-c2ccc(-c3c4ccccc4c(-c4ccc(-c5ccccc5)c5ccccc45)c4ccccc34)cc2)cc1
InChIInChI=1S/C42H28/c1-3-13-29(14-4-1)30-23-25-32(26-24-30)41-36-19-9-11-21-38(36)42(39-22-12-10-20-37(39)41)40-28-27-33(31-15-5-2-6-16-31)34-17-7-8-18-35(34)40/h1-28H
InChIKeyJDUHGLFLQKBWDW-UHFFFAOYSA-N
XLogP11.81
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms42
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500532.69
LogP ≤ 511.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze 9-(4-phenylnaphthalen-1-yl)-10-(4-phenylphenyl)anthracene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

9-(4-methylphenyl)-10-(4-phenylnaphthalen-1-yl)anthracene
CID 123303809
9-phenyl-10-[4-[6-[6-(10-phenylanthracen-9-yl)naphthalen-2-yl]naphthalen-2-yl]phenyl]anthracene;9-phenyl-10-[4-[4-(10-phenylanthracen-9-yl)naphthalen-1-yl]phenyl]anthracene;9-phenyl-10-[4-[6-(10-phenylanthracen-9-yl)naphthalen-2-yl]phenyl]anthracene;9-phenyl-10-[4-[4-[6-(10-phenylanthracen-9-yl)naphthalen-2-yl]phenyl]phenyl]anthracene;9-phenyl-10-[4-[4-[4-(10-phenylanthracen-9-yl)phenyl]naphthalen-1-yl]phenyl]anthracene;9-phenyl-10-[4-[6-[4-(10-phenylanthracen-9-yl)phenyl]naphthalen-2-yl]phenyl]anthracene
CID 159018384
9-[2-(4-phenylphenyl)phenyl]-10-[4-(4-phenylphenyl)phenyl]anthracene
CID 144568797
9-phenyl-10-[4-(6-phenylnaphthalen-2-yl)naphthalen-1-yl]anthracene
CID 142699645
triphenyl-[4-[10-(4-phenylnaphthalen-1-yl)anthracen-9-yl]phenyl]silane
CID 123924347
9-naphthalen-1-yl-10-[4-(4-naphthalen-1-ylnaphthalen-1-yl)phenyl]anthracene;9-naphthalen-1-yl-10-[4-(4-phenylnaphthalen-1-yl)phenyl]anthracene;9-naphthalen-1-yl-10-[4-(3-phenylphenyl)phenyl]anthracene
CID 159990389
9-(3,4-diphenylphenyl)-10-(4-phenylphenyl)anthracene
CID 164706372
9,10-bis[2-(4-phenylphenyl)phenyl]anthracene
CID 59090311
9-phenyl-10-[10-[4-(2-phenylphenyl)phenyl]anthracen-9-yl]anthracene
CID 140825339
methane;9-(4-phenylphenyl)-10-[10-(4-phenylphenyl)anthracen-9-yl]anthracene
CID 143224896
9-phenyl-10-[5-phenyl-8-[3-(4-phenylphenyl)phenyl]naphthalen-2-yl]anthracene
CID 144837443
9-naphthalen-1-yl-2,6-diphenyl-10-(5-phenylnaphthalen-1-yl)anthracene;10-naphthalen-1-yl-2-phenyl-9-(5-phenylnaphthalen-1-yl)anthracene;2,7,10-triphenyl-9-(5-phenylnaphthalen-1-yl)anthracene
CID 163914119

Frequently Asked Questions

What is the IUPAC name of 9-(4-phenylnaphthalen-1-yl)-10-(4-phenylphenyl)anthracene?
The IUPAC name of 9-(4-phenylnaphthalen-1-yl)-10-(4-phenylphenyl)anthracene (CID 123739520) is 9-(4-phenylnaphthalen-1-yl)-10-(4-phenylphenyl)anthracene.
What is the SMILES notation for 9-(4-phenylnaphthalen-1-yl)-10-(4-phenylphenyl)anthracene?
The canonical SMILES for 9-(4-phenylnaphthalen-1-yl)-10-(4-phenylphenyl)anthracene is c1ccc(-c2ccc(-c3c4ccccc4c(-c4ccc(-c5ccccc5)c5ccccc45)c4ccccc34)cc2)cc1.
What is the InChIKey of 9-(4-phenylnaphthalen-1-yl)-10-(4-phenylphenyl)anthracene?
The InChIKey is JDUHGLFLQKBWDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C42H28/c1-3-13-29(14-4-1)30-23-25-32(26-24-30)41-36-19-9-11-21-38(36)42(39-22-12-10-20-37(39)41)40-28-27-33(31-15-5-2-6-16-31)34-17-7-8-18-35(34)40/h1-28H.
What are the key properties of 9-(4-phenylnaphthalen-1-yl)-10-(4-phenylphenyl)anthracene?
9-(4-phenylnaphthalen-1-yl)-10-(4-phenylphenyl)anthracene has a molecular weight of 532.69 g/mol, XLogP of 11.81, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(4-phenylnaphthalen-1-yl)-10-(4-phenylphenyl)anthracene is sourced from PubChem (CID 123739520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).