2-phenyl-8-(7-triphenylen-2-ylnaphthalen-2-yl)dibenzofuran

C46H28O — CID 58569708

IUPAC2-phenyl-8-(7-triphenylen-2-ylnaphthalen-2-yl)dibenzofuran
SMILESc1ccc(-c2ccc3oc4ccc(-c5ccc6ccc(-c7ccc8c9ccccc9c9ccccc9c8c7)cc6c5)cc4c3c2)cc1
InChIInChI=1S/C46H28O/c1-2-8-29(9-3-1)33-19-22-45-43(27-33)44-28-35(20-23-46(44)47-45)32-17-15-30-14-16-31(24-36(30)25-32)34-18-21-41-39-12-5-4-10-37(39)38-11-6-7-13-40(38)42(41)26-34/h1-28H
InChIKeyUZIAXBGSWZQGDD-UHFFFAOYSA-N
MW596.73 g/mol
LogP13.20
Rot. Bonds3

About 2-phenyl-8-(7-triphenylen-2-ylnaphthalen-2-yl)dibenzofuran

2-phenyl-8-(7-triphenylen-2-ylnaphthalen-2-yl)dibenzofuran (PubChem CID 58569708) has the molecular formula C46H28O and a molecular weight of 596.73 g/mol. Its IUPAC name is 2-phenyl-8-(7-triphenylen-2-ylnaphthalen-2-yl)dibenzofuran.

Molecular Properties

Compound Name2-phenyl-8-(7-triphenylen-2-ylnaphthalen-2-yl)dibenzofuran
PubChem CID58569708
Molecular FormulaC46H28O
Molecular Weight596.73 g/mol
Exact Mass596.21
IUPAC Name2-phenyl-8-(7-triphenylen-2-ylnaphthalen-2-yl)dibenzofuran
SMILESc1ccc(-c2ccc3oc4ccc(-c5ccc6ccc(-c7ccc8c9ccccc9c9ccccc9c8c7)cc6c5)cc4c3c2)cc1
InChIInChI=1S/C46H28O/c1-2-8-29(9-3-1)33-19-22-45-43(27-33)44-28-35(20-23-46(44)47-45)32-17-15-30-14-16-31(24-36(30)25-32)34-18-21-41-39-12-5-4-10-37(39)38-11-6-7-13-40(38)42(41)26-34/h1-28H
InChIKeyUZIAXBGSWZQGDD-UHFFFAOYSA-N
XLogP13.20
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms47
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500596.73
LogP ≤ 513.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

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Related Compounds

2,8-bis(6-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran;2,8-bis(6-phenylnaphthalen-2-yl)dibenzofuran;2,8-bis(7-phenylnaphthalen-2-yl)dibenzofuran;2-[7-(cyclodecapentaenyl)naphthalen-2-yl]-8-(7-naphthalen-2-ylnaphthalen-2-yl)dibenzofuran
CID 158865776
2-[3-(4-phenylphenyl)phenyl]-8-(3-triphenylen-2-ylphenyl)dibenzofuran
CID 118349959
2-dibenzofuran-2-yl-4-naphthalen-2-yl-6-(7-phenylnaphthalen-2-yl)-1,3,5-triazine
CID 177119766
2-(6-phenanthren-9-ylnaphthalen-2-yl)-8-phenyldibenzofuran
CID 58569217
2-phenyl-4-(4-phenylphenyl)-6-(8-triphenylen-2-yldibenzofuran-3-yl)-1,3,5-triazine
CID 146407713
2-dibenzofuran-2-yl-4-(3-naphthalen-2-ylphenyl)-6-[3-(7-phenylnaphthalen-2-yl)phenyl]-1,3,5-triazine
CID 170942483
2-(10-dibenzofuran-2-yltriphenylen-2-yl)-4-phenyl-6-(3-phenylphenyl)-1,3,5-triazine
CID 166925794
2,4-dinaphthalen-2-yl-6-(7-phenyldibenzofuran-2-yl)-1,3,5-triazine
CID 176616855
2-phenyl-9-(10-phenylanthracen-9-yl)naphtho[2,3-b][1]benzofuran
CID 146606986
2-(8-naphthalen-2-yldibenzofuran-2-yl)-4-phenanthren-2-yl-6-phenyl-1,3,5-triazine
CID 176616795
2-(8-naphthalen-2-yldibenzofuran-3-yl)-4,6-bis(4-phenylphenyl)-1,3,5-triazine
CID 167402984
21-(6-phenylnaphthalen-2-yl)-14-oxaheptacyclo[15.12.0.03,15.04,13.05,10.018,23.024,29]nonacosa-1,3(15),4(13),5,7,9,11,16,18(23),19,21,24,26,28-tetradecaene
CID 149209334

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-8-(7-triphenylen-2-ylnaphthalen-2-yl)dibenzofuran?
The IUPAC name of 2-phenyl-8-(7-triphenylen-2-ylnaphthalen-2-yl)dibenzofuran (CID 58569708) is 2-phenyl-8-(7-triphenylen-2-ylnaphthalen-2-yl)dibenzofuran.
What is the SMILES notation for 2-phenyl-8-(7-triphenylen-2-ylnaphthalen-2-yl)dibenzofuran?
The canonical SMILES for 2-phenyl-8-(7-triphenylen-2-ylnaphthalen-2-yl)dibenzofuran is c1ccc(-c2ccc3oc4ccc(-c5ccc6ccc(-c7ccc8c9ccccc9c9ccccc9c8c7)cc6c5)cc4c3c2)cc1.
What is the InChIKey of 2-phenyl-8-(7-triphenylen-2-ylnaphthalen-2-yl)dibenzofuran?
The InChIKey is UZIAXBGSWZQGDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C46H28O/c1-2-8-29(9-3-1)33-19-22-45-43(27-33)44-28-35(20-23-46(44)47-45)32-17-15-30-14-16-31(24-36(30)25-32)34-18-21-41-39-12-5-4-10-37(39)38-11-6-7-13-40(38)42(41)26-34/h1-28H.
What are the key properties of 2-phenyl-8-(7-triphenylen-2-ylnaphthalen-2-yl)dibenzofuran?
2-phenyl-8-(7-triphenylen-2-ylnaphthalen-2-yl)dibenzofuran has a molecular weight of 596.73 g/mol, XLogP of 13.20, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-8-(7-triphenylen-2-ylnaphthalen-2-yl)dibenzofuran is sourced from PubChem (CID 58569708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).