9-phenyl-10-[7-phenyl-6-(3-phenylphenyl)naphthalen-2-yl]anthracene

C48H32 — CID 58590145

IUPAC9-phenyl-10-[7-phenyl-6-(3-phenylphenyl)naphthalen-2-yl]anthracene
SMILESc1ccc(-c2cccc(-c3cc4ccc(-c5c6ccccc6c(-c6ccccc6)c6ccccc56)cc4cc3-c3ccccc3)c2)cc1
InChIInChI=1S/C48H32/c1-4-15-33(16-5-1)36-21-14-22-38(29-36)46-31-37-27-28-39(30-40(37)32-45(46)34-17-6-2-7-18-34)48-43-25-12-10-23-41(43)47(35-19-8-3-9-20-35)42-24-11-13-26-44(42)48/h1-32H
InChIKeyPQDGRWUQEUOGHR-UHFFFAOYSA-N
MW608.78 g/mol
LogP13.48
Rot. Bonds5

About 9-phenyl-10-[7-phenyl-6-(3-phenylphenyl)naphthalen-2-yl]anthracene

9-phenyl-10-[7-phenyl-6-(3-phenylphenyl)naphthalen-2-yl]anthracene (PubChem CID 58590145) has the molecular formula C48H32 and a molecular weight of 608.78 g/mol. Its IUPAC name is 9-phenyl-10-[7-phenyl-6-(3-phenylphenyl)naphthalen-2-yl]anthracene.

Molecular Properties

Compound Name9-phenyl-10-[7-phenyl-6-(3-phenylphenyl)naphthalen-2-yl]anthracene
PubChem CID58590145
Molecular FormulaC48H32
Molecular Weight608.78 g/mol
Exact Mass608.25
IUPAC Name9-phenyl-10-[7-phenyl-6-(3-phenylphenyl)naphthalen-2-yl]anthracene
SMILESc1ccc(-c2cccc(-c3cc4ccc(-c5c6ccccc6c(-c6ccccc6)c6ccccc56)cc4cc3-c3ccccc3)c2)cc1
InChIInChI=1S/C48H32/c1-4-15-33(16-5-1)36-21-14-22-38(29-36)46-31-37-27-28-39(30-40(37)32-45(46)34-17-6-2-7-18-34)48-43-25-12-10-23-41(43)47(35-19-8-3-9-20-35)42-24-11-13-26-44(42)48/h1-32H
InChIKeyPQDGRWUQEUOGHR-UHFFFAOYSA-N
XLogP13.48
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms48
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500608.78
LogP ≤ 513.48
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-(3-anthracen-2-ylphenyl)-10-(4-phenylphenyl)anthracene
CID 164706350
9-(3-phenylphenyl)-10-[6-[10-(3-phenylphenyl)anthracen-9-yl]naphthalen-2-yl]anthracene
CID 153438367
9-(4-naphthalen-2-ylphenyl)-10-[7-(2-phenylphenyl)naphthalen-2-yl]anthracene
CID 123334632
9-(4-naphthalen-2-ylphenyl)-10-[3-(3-phenylphenyl)phenyl]anthracene
CID 144568832
9-naphthalen-2-yl-10-[7-[7-[3-(10-phenylanthracen-9-yl)phenyl]naphthalen-2-yl]naphthalen-2-yl]anthracene
CID 172546693
9-(4-naphthalen-2-ylphenyl)-10-(3-phenylphenyl)anthracene
CID 58151267
9-(3-naphthalen-2-ylphenyl)-10-[4-(4-phenylphenyl)phenyl]anthracene
CID 144568868
9,10-bis(3-naphthalen-1-ylphenyl)anthracene;9,10-bis(3-naphthalen-2-ylphenyl)anthracene;9,10-bis(4-naphthalen-1-ylphenyl)anthracene;9,10-bis(4-naphthalen-2-ylphenyl)anthracene;9-(3-naphthalen-1-ylphenyl)-10-(4-phenylphenyl)anthracene;9-(3-naphthalen-2-ylphenyl)-10-(4-phenylphenyl)anthracene;9-(4-naphthalen-1-ylphenyl)-10-(3-phenylphenyl)anthracene
CID 161131758
9-(4-naphthalen-1-ylphenyl)-10-[3-(6-phenylnaphthalen-2-yl)phenyl]anthracene
CID 58856435
9-[6-(3-phenylphenyl)naphthalen-2-yl]-10-[2-[3-(3-phenylphenyl)phenyl]phenyl]anthracene
CID 58965810
9-[3-(3,5-diphenylphenyl)phenyl]-10-[4-(3-naphthalen-2-ylphenyl)phenyl]anthracene
CID 59798540
9-(3,5-diphenylphenyl)-10-phenylanthracene;9-[3-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]-10-phenylanthracene;9-phenyl-10-[4-(4-phenylphenyl)phenyl]anthracene
CID 161401825

Frequently Asked Questions

What is the IUPAC name of 9-phenyl-10-[7-phenyl-6-(3-phenylphenyl)naphthalen-2-yl]anthracene?
The IUPAC name of 9-phenyl-10-[7-phenyl-6-(3-phenylphenyl)naphthalen-2-yl]anthracene (CID 58590145) is 9-phenyl-10-[7-phenyl-6-(3-phenylphenyl)naphthalen-2-yl]anthracene.
What is the SMILES notation for 9-phenyl-10-[7-phenyl-6-(3-phenylphenyl)naphthalen-2-yl]anthracene?
The canonical SMILES for 9-phenyl-10-[7-phenyl-6-(3-phenylphenyl)naphthalen-2-yl]anthracene is c1ccc(-c2cccc(-c3cc4ccc(-c5c6ccccc6c(-c6ccccc6)c6ccccc56)cc4cc3-c3ccccc3)c2)cc1.
What is the InChIKey of 9-phenyl-10-[7-phenyl-6-(3-phenylphenyl)naphthalen-2-yl]anthracene?
The InChIKey is PQDGRWUQEUOGHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H32/c1-4-15-33(16-5-1)36-21-14-22-38(29-36)46-31-37-27-28-39(30-40(37)32-45(46)34-17-6-2-7-18-34)48-43-25-12-10-23-41(43)47(35-19-8-3-9-20-35)42-24-11-13-26-44(42)48/h1-32H.
What are the key properties of 9-phenyl-10-[7-phenyl-6-(3-phenylphenyl)naphthalen-2-yl]anthracene?
9-phenyl-10-[7-phenyl-6-(3-phenylphenyl)naphthalen-2-yl]anthracene has a molecular weight of 608.78 g/mol, XLogP of 13.48, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9-phenyl-10-[7-phenyl-6-(3-phenylphenyl)naphthalen-2-yl]anthracene is sourced from PubChem (CID 58590145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).