2-(10-naphthalen-1-ylanthracen-9-yl)-4-(4-phenylnaphthalen-2-yl)dibenzofuran;2-[4-(10-naphthalen-1-ylanthracen-9-yl)phenyl]-7-(6-phenylnaphthalen-2-yl)dibenzofuran

C110H68O2 — CID 158350567

IUPAC2-(10-naphthalen-1-ylanthracen-9-yl)-4-(4-phenylnaphthalen-2-yl)dibenzofuran;2-[4-(10-naphthalen-1-ylanthracen-9-yl)phenyl]-7-(6-phenylnaphthalen-2-yl)dibenzofuran
SMILESc1ccc(-c2cc(-c3cc(-c4c5ccccc5c(-c5cccc6ccccc56)c5ccccc45)cc4c3oc3ccccc34)cc3ccccc23)cc1.c1ccc(-c2ccc3cc(-c4ccc5c(c4)oc4ccc(-c6ccc(-c7c8ccccc8c(-c8cccc9ccccc89)c8ccccc78)cc6)cc45)ccc3c2)cc1
InChIInChI=1S/C58H36O.C52H32O/c1-2-11-37(12-3-1)41-25-26-43-34-44(28-27-42(43)33-41)46-29-31-48-54-35-45(30-32-55(54)59-56(48)36-46)38-21-23-40(24-22-38)57-50-16-6-8-18-52(50)58(53-19-9-7-17-51(53)57)49-20-10-14-39-13-4-5-15-47(39)49;1-2-15-34(16-3-1)46-30-36(29-35-18-5-7-21-39(35)46)47-31-37(32-48-40-22-12-13-28-49(40)53-52(47)48)50-42-23-8-10-25-44(42)51(45-26-11-9-24-43(45)50)41-27-14-19-33-17-4-6-20-38(33)41/h1-36H;1-32H
InChIKeyGSGLIVPJOOYYCC-UHFFFAOYSA-N
MW1421.75 g/mol
LogP31.40
Rot. Bonds9

About 2-(10-naphthalen-1-ylanthracen-9-yl)-4-(4-phenylnaphthalen-2-yl)dibenzofuran;2-[4-(10-naphthalen-1-ylanthracen-9-yl)phenyl]-7-(6-phenylnaphthalen-2-yl)dibenzofuran

2-(10-naphthalen-1-ylanthracen-9-yl)-4-(4-phenylnaphthalen-2-yl)dibenzofuran;2-[4-(10-naphthalen-1-ylanthracen-9-yl)phenyl]-7-(6-phenylnaphthalen-2-yl)dibenzofuran (PubChem CID 158350567) has the molecular formula C110H68O2 and a molecular weight of 1421.75 g/mol. Its IUPAC name is 2-(10-naphthalen-1-ylanthracen-9-yl)-4-(4-phenylnaphthalen-2-yl)dibenzofuran;2-[4-(10-naphthalen-1-ylanthracen-9-yl)phenyl]-7-(6-phenylnaphthalen-2-yl)dibenzofuran.

Molecular Properties

Compound Name2-(10-naphthalen-1-ylanthracen-9-yl)-4-(4-phenylnaphthalen-2-yl)dibenzofuran;2-[4-(10-naphthalen-1-ylanthracen-9-yl)phenyl]-7-(6-phenylnaphthalen-2-yl)dibenzofuran
PubChem CID158350567
Molecular FormulaC110H68O2
Molecular Weight1421.75 g/mol
Exact Mass1420.52
IUPAC Name2-(10-naphthalen-1-ylanthracen-9-yl)-4-(4-phenylnaphthalen-2-yl)dibenzofuran;2-[4-(10-naphthalen-1-ylanthracen-9-yl)phenyl]-7-(6-phenylnaphthalen-2-yl)dibenzofuran
SMILESc1ccc(-c2cc(-c3cc(-c4c5ccccc5c(-c5cccc6ccccc56)c5ccccc45)cc4c3oc3ccccc34)cc3ccccc23)cc1.c1ccc(-c2ccc3cc(-c4ccc5c(c4)oc4ccc(-c6ccc(-c7c8ccccc8c(-c8cccc9ccccc89)c8ccccc78)cc6)cc45)ccc3c2)cc1
InChIInChI=1S/C58H36O.C52H32O/c1-2-11-37(12-3-1)41-25-26-43-34-44(28-27-42(43)33-41)46-29-31-48-54-35-45(30-32-55(54)59-56(48)36-46)38-21-23-40(24-22-38)57-50-16-6-8-18-52(50)58(53-19-9-7-17-51(53)57)49-20-10-14-39-13-4-5-15-47(39)49;1-2-15-34(16-3-1)46-30-36(29-35-18-5-7-21-39(35)46)47-31-37(32-48-40-22-12-13-28-49(40)53-52(47)48)50-42-23-8-10-25-44(42)51(45-26-11-9-24-43(45)50)41-27-14-19-33-17-4-6-20-38(33)41/h1-36H;1-32H
InChIKeyGSGLIVPJOOYYCC-UHFFFAOYSA-N
XLogP31.40
TPSA26.28 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms112
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001421.75
LogP ≤ 531.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-[4-(10-naphthalen-1-ylanthracen-9-yl)phenyl]-6-phenanthren-9-yldibenzofuran;2-[4-(10-naphthalen-1-ylanthracen-9-yl)phenyl]-7-(6-phenylnaphthalen-2-yl)dibenzofuran
CID 158272088
2-phenyl-7-[10-(6-phenylnaphthalen-1-yl)anthracen-9-yl]dibenzofuran;3-phenyl-7-[10-(6-phenylnaphthalen-2-yl)anthracen-9-yl]dibenzofuran
CID 161333068
2-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]dibenzofuran;3-[10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]dibenzofuran;2-[4-(10-phenylanthracen-9-yl)phenyl]dibenzofuran
CID 159962992
2-[4-(10-naphthalen-1-ylanthracen-9-yl)phenyl]dibenzofuran;2-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]dibenzofuran;4-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]dibenzofuran;2-[4-[10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]phenyl]dibenzofuran;2-[4-(10-phenylanthracen-9-yl)phenyl]dibenzofuran;2-[4-[10-(3-phenylphenyl)anthracen-9-yl]phenyl]dibenzofuran;2-[4-[10-(4-phenylphenyl)anthracen-9-yl]phenyl]dibenzofuran
CID 158528042
4-[6-[4-[10-(6-naphthalen-1-yldibenzofuran-2-yl)anthracen-9-yl]phenyl]naphthalen-1-yl]-2-(10-phenylanthracen-9-yl)dibenzofuran
CID 166928345
9,10-bis(3-phenylphenyl)anthracene;9,10-bis(4-phenylphenyl)anthracene;2-(10-dibenzofuran-4-ylanthracen-9-yl)dibenzofuran;9,10-dinaphthalen-1-ylanthracene;9,10-dinaphthalen-2-ylanthracene;9,10-di(phenanthren-9-yl)anthracene
CID 159984681
2-(10-naphthalen-2-ylanthracen-9-yl)-6-phenyldibenzofuran;3-naphthalen-1-yl-2-(10-naphthalen-1-ylanthracen-9-yl)dibenzofuran;4-naphthalen-1-yl-2-(10-naphthalen-1-ylanthracen-9-yl)dibenzofuran
CID 164965808
9-naphthalen-1-yl-10-[4-(6-phenylnaphthalen-2-yl)phenyl]anthracene;9-[6-(4-phenanthren-9-ylphenyl)naphthalen-1-yl]-10-phenylanthracene;4-(10-phenylanthracen-9-yl)dibenzofuran;4-[3-[5-(10-phenylanthracen-9-yl)naphthalen-2-yl]phenyl]dibenzofuran
CID 165012926
4-[4-(10-naphthalen-1-yl-2-phenylanthracen-9-yl)phenyl]dibenzofuran
CID 58323634
2-(10-naphthalen-1-ylanthracen-9-yl)dibenzofuran;2-[4-(10-naphthalen-1-ylanthracen-9-yl)phenyl]dibenzofuran;4-[4-(10-naphthalen-1-ylanthracen-9-yl)phenyl]dibenzofuran
CID 159891150
9-(4-naphthalen-1-ylnaphthalen-1-yl)-10-phenanthren-2-ylanthracene;2-[6-(10-phenanthren-2-ylanthracen-9-yl)naphthalen-2-yl]dibenzofuran;4-[4-(10-phenanthren-2-ylanthracen-9-yl)naphthalen-1-yl]dibenzofuran;9-phenanthren-2-yl-10-[4-(2-phenylphenyl)naphthalen-1-yl]anthracene;9-phenanthren-2-yl-10-[4-(3-phenylphenyl)naphthalen-1-yl]anthracene;9-phenanthren-2-yl-10-[4-(4-phenylphenyl)naphthalen-1-yl]anthracene
CID 160952917
deuterium monohydride;2-[10-(7-naphthalen-2-ylnaphthalen-1-yl)anthracen-9-yl]dibenzofuran;2-[10-[6-(3-phenylphenyl)naphthalen-1-yl]anthracen-9-yl]dibenzofuran;2-[10-[7-(3-phenylphenyl)naphthalen-1-yl]anthracen-9-yl]dibenzofuran
CID 163644950

Frequently Asked Questions

What is the IUPAC name of 2-(10-naphthalen-1-ylanthracen-9-yl)-4-(4-phenylnaphthalen-2-yl)dibenzofuran;2-[4-(10-naphthalen-1-ylanthracen-9-yl)phenyl]-7-(6-phenylnaphthalen-2-yl)dibenzofuran?
The IUPAC name of 2-(10-naphthalen-1-ylanthracen-9-yl)-4-(4-phenylnaphthalen-2-yl)dibenzofuran;2-[4-(10-naphthalen-1-ylanthracen-9-yl)phenyl]-7-(6-phenylnaphthalen-2-yl)dibenzofuran (CID 158350567) is 2-(10-naphthalen-1-ylanthracen-9-yl)-4-(4-phenylnaphthalen-2-yl)dibenzofuran;2-[4-(10-naphthalen-1-ylanthracen-9-yl)phenyl]-7-(6-phenylnaphthalen-2-yl)dibenzofuran.
What is the SMILES notation for 2-(10-naphthalen-1-ylanthracen-9-yl)-4-(4-phenylnaphthalen-2-yl)dibenzofuran;2-[4-(10-naphthalen-1-ylanthracen-9-yl)phenyl]-7-(6-phenylnaphthalen-2-yl)dibenzofuran?
The canonical SMILES for 2-(10-naphthalen-1-ylanthracen-9-yl)-4-(4-phenylnaphthalen-2-yl)dibenzofuran;2-[4-(10-naphthalen-1-ylanthracen-9-yl)phenyl]-7-(6-phenylnaphthalen-2-yl)dibenzofuran is c1ccc(-c2cc(-c3cc(-c4c5ccccc5c(-c5cccc6ccccc56)c5ccccc45)cc4c3oc3ccccc34)cc3ccccc23)cc1.c1ccc(-c2ccc3cc(-c4ccc5c(c4)oc4ccc(-c6ccc(-c7c8ccccc8c(-c8cccc9ccccc89)c8ccccc78)cc6)cc45)ccc3c2)cc1.
What is the InChIKey of 2-(10-naphthalen-1-ylanthracen-9-yl)-4-(4-phenylnaphthalen-2-yl)dibenzofuran;2-[4-(10-naphthalen-1-ylanthracen-9-yl)phenyl]-7-(6-phenylnaphthalen-2-yl)dibenzofuran?
The InChIKey is GSGLIVPJOOYYCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C58H36O.C52H32O/c1-2-11-37(12-3-1)41-25-26-43-34-44(28-27-42(43)33-41)46-29-31-48-54-35-45(30-32-55(54)59-56(48)36-46)38-21-23-40(24-22-38)57-50-16-6-8-18-52(50)58(53-19-9-7-17-51(53)57)49-20-10-14-39-13-4-5-15-47(39)49;1-2-15-34(16-3-1)46-30-36(29-35-18-5-7-21-39(35)46)47-31-37(32-48-40-22-12-13-28-49(40)53-52(47)48)50-42-23-8-10-25-44(42)51(45-26-11-9-24-43(45)50)41-27-14-19-33-17-4-6-20-38(33)41/h1-36H;1-32H.
What are the key properties of 2-(10-naphthalen-1-ylanthracen-9-yl)-4-(4-phenylnaphthalen-2-yl)dibenzofuran;2-[4-(10-naphthalen-1-ylanthracen-9-yl)phenyl]-7-(6-phenylnaphthalen-2-yl)dibenzofuran?
2-(10-naphthalen-1-ylanthracen-9-yl)-4-(4-phenylnaphthalen-2-yl)dibenzofuran;2-[4-(10-naphthalen-1-ylanthracen-9-yl)phenyl]-7-(6-phenylnaphthalen-2-yl)dibenzofuran has a molecular weight of 1421.75 g/mol, XLogP of 31.40, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(10-naphthalen-1-ylanthracen-9-yl)-4-(4-phenylnaphthalen-2-yl)dibenzofuran;2-[4-(10-naphthalen-1-ylanthracen-9-yl)phenyl]-7-(6-phenylnaphthalen-2-yl)dibenzofuran is sourced from PubChem (CID 158350567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).