9-naphthalen-2-yl-10-(2-naphthalen-2-yl-6-phenylphenyl)anthracene

C46H30 — CID 171447256

IUPAC9-naphthalen-2-yl-10-(2-naphthalen-2-yl-6-phenylphenyl)anthracene
SMILESc1ccc(-c2cccc(-c3ccc4ccccc4c3)c2-c2c3ccccc3c(-c3ccc4ccccc4c3)c3ccccc23)cc1
InChIInChI=1S/C46H30/c1-2-15-33(16-3-1)38-23-12-24-39(36-27-25-31-13-4-6-17-34(31)29-36)45(38)46-42-21-10-8-19-40(42)44(41-20-9-11-22-43(41)46)37-28-26-32-14-5-7-18-35(32)30-37/h1-30H
InChIKeyGHNOOPNNTXVYMZ-UHFFFAOYSA-N
MW582.75 g/mol
LogP12.97
Rot. Bonds4

About 9-naphthalen-2-yl-10-(2-naphthalen-2-yl-6-phenylphenyl)anthracene

9-naphthalen-2-yl-10-(2-naphthalen-2-yl-6-phenylphenyl)anthracene (PubChem CID 171447256) has the molecular formula C46H30 and a molecular weight of 582.75 g/mol. Its IUPAC name is 9-naphthalen-2-yl-10-(2-naphthalen-2-yl-6-phenylphenyl)anthracene.

Molecular Properties

Compound Name9-naphthalen-2-yl-10-(2-naphthalen-2-yl-6-phenylphenyl)anthracene
PubChem CID171447256
Molecular FormulaC46H30
Molecular Weight582.75 g/mol
Exact Mass582.23
IUPAC Name9-naphthalen-2-yl-10-(2-naphthalen-2-yl-6-phenylphenyl)anthracene
SMILESc1ccc(-c2cccc(-c3ccc4ccccc4c3)c2-c2c3ccccc3c(-c3ccc4ccccc4c3)c3ccccc23)cc1
InChIInChI=1S/C46H30/c1-2-15-33(16-3-1)38-23-12-24-39(36-27-25-31-13-4-6-17-34(31)29-36)45(38)46-42-21-10-8-19-40(42)44(41-20-9-11-22-43(41)46)37-28-26-32-14-5-7-18-35(32)30-37/h1-30H
InChIKeyGHNOOPNNTXVYMZ-UHFFFAOYSA-N
XLogP12.97
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms46
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500582.75
LogP ≤ 512.97
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-(2,6-diphenylphenyl)phenyl]-10-naphthalen-2-ylanthracene
CID 58965768
9-[2-(9H-fluoren-2-yl)-6-phenylphenyl]-10-naphthalen-2-ylanthracene
CID 171447247
9-[6-(4,5-diphenylnaphthalen-1-yl)naphthalen-2-yl]-10-naphthalen-2-ylanthracene
CID 123216582
9-[3-(1-naphthalen-2-ylnaphthalen-2-yl)phenyl]-10-[4-(2-phenylnaphthalen-1-yl)phenyl]anthracene
CID 59413105
9-naphthalen-2-yl-10-(10-phenylanthracen-9-yl)anthracene
CID 59557532
9-(4-naphthalen-2-ylphenyl)-10-[7-(2-phenylphenyl)naphthalen-2-yl]anthracene
CID 123334632
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-naphthalen-2-yl-10-[10-(2-phenylphenyl)anthracen-9-yl]anthracene;9-naphthalen-2-yl-10-[10-(3-phenylphenyl)anthracen-9-yl]anthracene;9-naphthalen-2-yl-10-[10-(4-phenylphenyl)anthracen-9-yl]anthracene;9-phenyl-10-[4-(10-phenylanthracen-9-yl)phenyl]anthracene
CID 159178358
9-naphthalen-2-yl-10-(10-phenylanthracen-9-yl)anthracene;9-naphthalen-2-yl-10-[10-(2-phenylphenyl)anthracen-9-yl]anthracene;9-naphthalen-2-yl-10-[10-(3-phenylphenyl)anthracen-9-yl]anthracene;9-naphthalen-2-yl-10-[10-(4-phenylphenyl)anthracen-9-yl]anthracene
CID 161288409
10-naphthalen-2-yl-1-(4-phenylphenyl)anthracene
CID 173141630
9-naphthalen-2-yl-1-phenyl-10-(4-phenylphenyl)anthracene
CID 58323204
9-naphthalen-2-yl-10-[4-(10-phenylanthracen-9-yl)phenyl]anthracene
CID 58876197

Frequently Asked Questions

What is the IUPAC name of 9-naphthalen-2-yl-10-(2-naphthalen-2-yl-6-phenylphenyl)anthracene?
The IUPAC name of 9-naphthalen-2-yl-10-(2-naphthalen-2-yl-6-phenylphenyl)anthracene (CID 171447256) is 9-naphthalen-2-yl-10-(2-naphthalen-2-yl-6-phenylphenyl)anthracene.
What is the SMILES notation for 9-naphthalen-2-yl-10-(2-naphthalen-2-yl-6-phenylphenyl)anthracene?
The canonical SMILES for 9-naphthalen-2-yl-10-(2-naphthalen-2-yl-6-phenylphenyl)anthracene is c1ccc(-c2cccc(-c3ccc4ccccc4c3)c2-c2c3ccccc3c(-c3ccc4ccccc4c3)c3ccccc23)cc1.
What is the InChIKey of 9-naphthalen-2-yl-10-(2-naphthalen-2-yl-6-phenylphenyl)anthracene?
The InChIKey is GHNOOPNNTXVYMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C46H30/c1-2-15-33(16-3-1)38-23-12-24-39(36-27-25-31-13-4-6-17-34(31)29-36)45(38)46-42-21-10-8-19-40(42)44(41-20-9-11-22-43(41)46)37-28-26-32-14-5-7-18-35(32)30-37/h1-30H.
What are the key properties of 9-naphthalen-2-yl-10-(2-naphthalen-2-yl-6-phenylphenyl)anthracene?
9-naphthalen-2-yl-10-(2-naphthalen-2-yl-6-phenylphenyl)anthracene has a molecular weight of 582.75 g/mol, XLogP of 12.97, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9-naphthalen-2-yl-10-(2-naphthalen-2-yl-6-phenylphenyl)anthracene is sourced from PubChem (CID 171447256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).