9-[8-(4-methylphenyl)naphthalen-2-yl]-10-phenylanthracene

C37H26 — CID 144837262

IUPAC9-[8-(4-methylphenyl)naphthalen-2-yl]-10-phenylanthracene
SMILESCc1ccc(-c2cccc3ccc(-c4c5ccccc5c(-c5ccccc5)c5ccccc45)cc23)cc1
InChIInChI=1S/C37H26/c1-25-18-20-27(21-19-25)30-17-9-12-26-22-23-29(24-35(26)30)37-33-15-7-5-13-31(33)36(28-10-3-2-4-11-28)32-14-6-8-16-34(32)37/h2-24H,1H3
InChIKeyJSDUINYTTVHYBH-UHFFFAOYSA-N
MW470.62 g/mol
LogP10.46
Rot. Bonds3

About 9-[8-(4-methylphenyl)naphthalen-2-yl]-10-phenylanthracene

9-[8-(4-methylphenyl)naphthalen-2-yl]-10-phenylanthracene (PubChem CID 144837262) has the molecular formula C37H26 and a molecular weight of 470.62 g/mol. Its IUPAC name is 9-[8-(4-methylphenyl)naphthalen-2-yl]-10-phenylanthracene.

Molecular Properties

Compound Name9-[8-(4-methylphenyl)naphthalen-2-yl]-10-phenylanthracene
PubChem CID144837262
Molecular FormulaC37H26
Molecular Weight470.62 g/mol
Exact Mass470.20
IUPAC Name9-[8-(4-methylphenyl)naphthalen-2-yl]-10-phenylanthracene
SMILESCc1ccc(-c2cccc3ccc(-c4c5ccccc5c(-c5ccccc5)c5ccccc45)cc23)cc1
InChIInChI=1S/C37H26/c1-25-18-20-27(21-19-25)30-17-9-12-26-22-23-29(24-35(26)30)37-33-15-7-5-13-31(33)36(28-10-3-2-4-11-28)32-14-6-8-16-34(32)37/h2-24H,1H3
InChIKeyJSDUINYTTVHYBH-UHFFFAOYSA-N
XLogP10.46
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms37
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500470.62
LogP ≤ 510.46
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-(4-methylphenyl)-10-[8-(4-phenylphenyl)naphthalen-2-yl]anthracene
CID 144837228
9-[8-(4-naphthalen-1-ylphenyl)naphthalen-2-yl]-10-phenylanthracene
CID 144837308
9-(3-methylphenyl)-10-[8-(2-phenylphenyl)naphthalen-2-yl]anthracene
CID 144837207
9-naphthalen-1-yl-10-[7-[8-[10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]naphthalen-2-yl]naphthalen-1-yl]anthracene
CID 172546641
2-(4-methylphenyl)-10-naphthalen-1-yl-9-phenylanthracene
CID 59766405
9-[8-(3-phenanthren-9-ylphenyl)naphthalen-2-yl]-10-phenylanthracene
CID 144837293
3,6-bis[10-(4-methylphenyl)anthracen-9-yl]phenanthrene
CID 168838204
2,9-dinaphthalen-1-yl-10-phenylanthracene;9-naphthalen-1-yl-10-phenyl-2-(5-phenylnaphthalen-1-yl)anthracene
CID 162243145
9-naphthalen-1-yl-10-[6-(10-phenylanthracen-9-yl)naphthalen-2-yl]anthracene
CID 58876135
9-(4-naphthalen-1-ylphenyl)-10-[3-(4-phenylphenyl)phenyl]anthracene
CID 144568905
9-naphthalen-1-yl-10-[3-[8-(10-naphthalen-1-ylanthracen-9-yl)naphthalen-2-yl]phenyl]anthracene
CID 168786914
9-[3-[3-(4-naphthalen-1-ylphenyl)phenyl]phenyl]-10-phenylanthracene
CID 123523837

Frequently Asked Questions

What is the IUPAC name of 9-[8-(4-methylphenyl)naphthalen-2-yl]-10-phenylanthracene?
The IUPAC name of 9-[8-(4-methylphenyl)naphthalen-2-yl]-10-phenylanthracene (CID 144837262) is 9-[8-(4-methylphenyl)naphthalen-2-yl]-10-phenylanthracene.
What is the SMILES notation for 9-[8-(4-methylphenyl)naphthalen-2-yl]-10-phenylanthracene?
The canonical SMILES for 9-[8-(4-methylphenyl)naphthalen-2-yl]-10-phenylanthracene is Cc1ccc(-c2cccc3ccc(-c4c5ccccc5c(-c5ccccc5)c5ccccc45)cc23)cc1.
What is the InChIKey of 9-[8-(4-methylphenyl)naphthalen-2-yl]-10-phenylanthracene?
The InChIKey is JSDUINYTTVHYBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C37H26/c1-25-18-20-27(21-19-25)30-17-9-12-26-22-23-29(24-35(26)30)37-33-15-7-5-13-31(33)36(28-10-3-2-4-11-28)32-14-6-8-16-34(32)37/h2-24H,1H3.
What are the key properties of 9-[8-(4-methylphenyl)naphthalen-2-yl]-10-phenylanthracene?
9-[8-(4-methylphenyl)naphthalen-2-yl]-10-phenylanthracene has a molecular weight of 470.62 g/mol, XLogP of 10.46, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[8-(4-methylphenyl)naphthalen-2-yl]-10-phenylanthracene is sourced from PubChem (CID 144837262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).