9-(4-naphthalen-2-ylphenyl)-10-(3-phenylphenyl)anthracene

C42H28 — CID 58151267

IUPAC9-(4-naphthalen-2-ylphenyl)-10-(3-phenylphenyl)anthracene
SMILESc1ccc(-c2cccc(-c3c4ccccc4c(-c4ccc(-c5ccc6ccccc6c5)cc4)c4ccccc34)c2)cc1
InChIInChI=1S/C42H28/c1-2-11-29(12-3-1)34-15-10-16-36(28-34)42-39-19-8-6-17-37(39)41(38-18-7-9-20-40(38)42)32-24-21-31(22-25-32)35-26-23-30-13-4-5-14-33(30)27-35/h1-28H
InChIKeyVSAGPPPBGWQNKJ-UHFFFAOYSA-N
MW532.69 g/mol
LogP11.81
Rot. Bonds4

About 9-(4-naphthalen-2-ylphenyl)-10-(3-phenylphenyl)anthracene

9-(4-naphthalen-2-ylphenyl)-10-(3-phenylphenyl)anthracene (PubChem CID 58151267) has the molecular formula C42H28 and a molecular weight of 532.69 g/mol. Its IUPAC name is 9-(4-naphthalen-2-ylphenyl)-10-(3-phenylphenyl)anthracene.

Molecular Properties

Compound Name9-(4-naphthalen-2-ylphenyl)-10-(3-phenylphenyl)anthracene
PubChem CID58151267
Molecular FormulaC42H28
Molecular Weight532.69 g/mol
Exact Mass532.22
IUPAC Name9-(4-naphthalen-2-ylphenyl)-10-(3-phenylphenyl)anthracene
SMILESc1ccc(-c2cccc(-c3c4ccccc4c(-c4ccc(-c5ccc6ccccc6c5)cc4)c4ccccc34)c2)cc1
InChIInChI=1S/C42H28/c1-2-11-29(12-3-1)34-15-10-16-36(28-34)42-39-19-8-6-17-37(39)41(38-18-7-9-20-40(38)42)32-24-21-31(22-25-32)35-26-23-30-13-4-5-14-33(30)27-35/h1-28H
InChIKeyVSAGPPPBGWQNKJ-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'}

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Related Compounds

9-(3-naphthalen-2-ylphenyl)-10-[4-(4-phenylphenyl)phenyl]anthracene
CID 144568868
9-(4-naphthalen-2-ylphenyl)-10-[3-(3-phenylphenyl)phenyl]anthracene
CID 144568832
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
9-[6-(3-naphthalen-2-yl-5-phenylphenyl)naphthalen-2-yl]-10-phenylanthracene
CID 58590127
9-naphthalen-2-yl-10-[7-[7-[3-(10-phenylanthracen-9-yl)phenyl]naphthalen-2-yl]naphthalen-2-yl]anthracene
CID 172546693
9-[3,5-bis[4-(3-phenylphenyl)phenyl]phenyl]-10-naphthalen-2-ylanthracene
CID 58965758
9-(3-anthracen-2-ylphenyl)-10-(4-phenylphenyl)anthracene
CID 164706350
9-naphthalen-2-yl-10-[7-[7-[4-(10-phenylanthracen-9-yl)phenyl]naphthalen-2-yl]naphthalen-2-yl]anthracene
CID 172546716
9,10-dinaphthalen-2-ylanthracene;9-naphthalen-2-yl-10-(6-phenylnaphthalen-2-yl)anthracene
CID 143848431
9-(3-phenylphenyl)-10-[6-[10-(3-phenylphenyl)anthracen-9-yl]naphthalen-2-yl]anthracene
CID 153438367
9-naphthalen-2-yl-2-(3-naphthalen-2-ylphenyl)-10-(4-naphthalen-2-ylphenyl)anthracene
CID 162700922

Frequently Asked Questions

What is the IUPAC name of 9-(4-naphthalen-2-ylphenyl)-10-(3-phenylphenyl)anthracene?
The IUPAC name of 9-(4-naphthalen-2-ylphenyl)-10-(3-phenylphenyl)anthracene (CID 58151267) is 9-(4-naphthalen-2-ylphenyl)-10-(3-phenylphenyl)anthracene.
What is the SMILES notation for 9-(4-naphthalen-2-ylphenyl)-10-(3-phenylphenyl)anthracene?
The canonical SMILES for 9-(4-naphthalen-2-ylphenyl)-10-(3-phenylphenyl)anthracene is c1ccc(-c2cccc(-c3c4ccccc4c(-c4ccc(-c5ccc6ccccc6c5)cc4)c4ccccc34)c2)cc1.
What is the InChIKey of 9-(4-naphthalen-2-ylphenyl)-10-(3-phenylphenyl)anthracene?
The InChIKey is VSAGPPPBGWQNKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C42H28/c1-2-11-29(12-3-1)34-15-10-16-36(28-34)42-39-19-8-6-17-37(39)41(38-18-7-9-20-40(38)42)32-24-21-31(22-25-32)35-26-23-30-13-4-5-14-33(30)27-35/h1-28H.
What are the key properties of 9-(4-naphthalen-2-ylphenyl)-10-(3-phenylphenyl)anthracene?
9-(4-naphthalen-2-ylphenyl)-10-(3-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-naphthalen-2-ylphenyl)-10-(3-phenylphenyl)anthracene is sourced from PubChem (CID 58151267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).