2-tert-butyl-6-[3-(9,10-diphenylanthracen-2-yl)phenyl]dibenzofuran;6-[3-(9,10-diphenylanthracen-2-yl)phenyl]-2-naphthalen-2-yldibenzofuran;6-[3-(9,10-diphenylanthracen-2-yl)phenyl]-2-phenyldibenzofuran;6-[3-(9,10-diphenylanthracen-2-yl)phenyl]-2-(3-phenylphenyl)dibenzofuran

C208H138O4 — CID 160998426

IUPAC2-tert-butyl-6-[3-(9,10-diphenylanthracen-2-yl)phenyl]dibenzofuran;6-[3-(9,10-diphenylanthracen-2-yl)phenyl]-2-naphthalen-2-yldibenzofuran;6-[3-(9,10-diphenylanthracen-2-yl)phenyl]-2-phenyldibenzofuran;6-[3-(9,10-diphenylanthracen-2-yl)phenyl]-2-(3-phenylphenyl)dibenzofuran
SMILESCC(C)(C)c1ccc2oc3c(-c4cccc(-c5ccc6c(-c7ccccc7)c7ccccc7c(-c7ccccc7)c6c5)c4)cccc3c2c1.c1ccc(-c2c3ccccc3c(-c3ccccc3)c3cc(-c4cccc(-c5cccc6c5oc5ccc(-c7ccc8ccccc8c7)cc56)c4)ccc23)cc1.c1ccc(-c2ccc3oc4c(-c5cccc(-c6ccc7c(-c8ccccc8)c8ccccc8c(-c8ccccc8)c7c6)c5)cccc4c3c2)cc1.c1ccc(-c2cccc(-c3ccc4oc5c(-c6cccc(-c7ccc8c(-c9ccccc9)c9ccccc9c(-c9ccccc9)c8c7)c6)cccc5c4c3)c2)cc1
InChIInChI=1S/C56H36O.C54H34O.C50H32O.C48H36O/c1-4-15-37(16-5-1)40-21-12-22-41(33-40)44-30-32-53-51(35-44)50-28-14-27-46(56(50)57-53)45-24-13-23-42(34-45)43-29-31-49-52(36-43)55(39-19-8-3-9-20-39)48-26-11-10-25-47(48)54(49)38-17-6-2-7-18-38;1-3-14-36(15-4-1)52-45-21-9-10-22-46(45)53(37-16-5-2-6-17-37)50-34-41(27-29-47(50)52)39-19-11-20-43(32-39)44-23-12-24-48-49-33-42(28-30-51(49)55-54(44)48)40-26-25-35-13-7-8-18-38(35)31-40;1-4-14-33(15-5-1)37-27-29-47-45(31-37)44-25-13-24-40(50(44)51-47)39-21-12-20-36(30-39)38-26-28-43-46(32-38)49(35-18-8-3-9-19-35)42-23-11-10-22-41(42)48(43)34-16-6-2-7-17-34;1-48(2,3)36-25-27-44-42(30-36)41-23-13-22-37(47(41)49-44)35-19-12-18-33(28-35)34-24-26-40-43(29-34)46(32-16-8-5-9-17-32)39-21-11-10-20-38(39)45(40)31-14-6-4-7-15-31/h1-36H;1-34H;1-32H;4-30H,1-3H3
InChIKeyTVNYNIZTAFHQEP-UHFFFAOYSA-N
MW2701.39 g/mol
LogP59.36
Rot. Bonds20

About 2-tert-butyl-6-[3-(9,10-diphenylanthracen-2-yl)phenyl]dibenzofuran;6-[3-(9,10-diphenylanthracen-2-yl)phenyl]-2-naphthalen-2-yldibenzofuran;6-[3-(9,10-diphenylanthracen-2-yl)phenyl]-2-phenyldibenzofuran;6-[3-(9,10-diphenylanthracen-2-yl)phenyl]-2-(3-phenylphenyl)dibenzofuran

2-tert-butyl-6-[3-(9,10-diphenylanthracen-2-yl)phenyl]dibenzofuran;6-[3-(9,10-diphenylanthracen-2-yl)phenyl]-2-naphthalen-2-yldibenzofuran;6-[3-(9,10-diphenylanthracen-2-yl)phenyl]-2-phenyldibenzofuran;6-[3-(9,10-diphenylanthracen-2-yl)phenyl]-2-(3-phenylphenyl)dibenzofuran (PubChem CID 160998426) has the molecular formula C208H138O4 and a molecular weight of 2701.39 g/mol. Its IUPAC name is 2-tert-butyl-6-[3-(9,10-diphenylanthracen-2-yl)phenyl]dibenzofuran;6-[3-(9,10-diphenylanthracen-2-yl)phenyl]-2-naphthalen-2-yldibenzofuran;6-[3-(9,10-diphenylanthracen-2-yl)phenyl]-2-phenyldibenzofuran;6-[3-(9,10-diphenylanthracen-2-yl)phenyl]-2-(3-phenylphenyl)dibenzofuran.

Molecular Properties

Compound Name2-tert-butyl-6-[3-(9,10-diphenylanthracen-2-yl)phenyl]dibenzofuran;6-[3-(9,10-diphenylanthracen-2-yl)phenyl]-2-naphthalen-2-yldibenzofuran;6-[3-(9,10-diphenylanthracen-2-yl)phenyl]-2-phenyldibenzofuran;6-[3-(9,10-diphenylanthracen-2-yl)phenyl]-2-(3-phenylphenyl)dibenzofuran
PubChem CID160998426
Molecular FormulaC208H138O4
Molecular Weight2701.39 g/mol
Exact Mass2699.06
IUPAC Name2-tert-butyl-6-[3-(9,10-diphenylanthracen-2-yl)phenyl]dibenzofuran;6-[3-(9,10-diphenylanthracen-2-yl)phenyl]-2-naphthalen-2-yldibenzofuran;6-[3-(9,10-diphenylanthracen-2-yl)phenyl]-2-phenyldibenzofuran;6-[3-(9,10-diphenylanthracen-2-yl)phenyl]-2-(3-phenylphenyl)dibenzofuran
SMILESCC(C)(C)c1ccc2oc3c(-c4cccc(-c5ccc6c(-c7ccccc7)c7ccccc7c(-c7ccccc7)c6c5)c4)cccc3c2c1.c1ccc(-c2c3ccccc3c(-c3ccccc3)c3cc(-c4cccc(-c5cccc6c5oc5ccc(-c7ccc8ccccc8c7)cc56)c4)ccc23)cc1.c1ccc(-c2ccc3oc4c(-c5cccc(-c6ccc7c(-c8ccccc8)c8ccccc8c(-c8ccccc8)c7c6)c5)cccc4c3c2)cc1.c1ccc(-c2cccc(-c3ccc4oc5c(-c6cccc(-c7ccc8c(-c9ccccc9)c9ccccc9c(-c9ccccc9)c8c7)c6)cccc5c4c3)c2)cc1
InChIInChI=1S/C56H36O.C54H34O.C50H32O.C48H36O/c1-4-15-37(16-5-1)40-21-12-22-41(33-40)44-30-32-53-51(35-44)50-28-14-27-46(56(50)57-53)45-24-13-23-42(34-45)43-29-31-49-52(36-43)55(39-19-8-3-9-20-39)48-26-11-10-25-47(48)54(49)38-17-6-2-7-18-38;1-3-14-36(15-4-1)52-45-21-9-10-22-46(45)53(37-16-5-2-6-17-37)50-34-41(27-29-47(50)52)39-19-11-20-43(32-39)44-23-12-24-48-49-33-42(28-30-51(49)55-54(44)48)40-26-25-35-13-7-8-18-38(35)31-40;1-4-14-33(15-5-1)37-27-29-47-45(31-37)44-25-13-24-40(50(44)51-47)39-21-12-20-36(30-39)38-26-28-43-46(32-38)49(35-18-8-3-9-19-35)42-23-11-10-22-41(42)48(43)34-16-6-2-7-17-34;1-48(2,3)36-25-27-44-42(30-36)41-23-13-22-37(47(41)49-44)35-19-12-18-33(28-35)34-24-26-40-43(29-34)46(32-16-8-5-9-17-32)39-21-11-10-20-38(39)45(40)31-14-6-4-7-15-31/h1-36H;1-34H;1-32H;4-30H,1-3H3
InChIKeyTVNYNIZTAFHQEP-UHFFFAOYSA-N
XLogP59.36
TPSA52.56 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds20
Heavy Atoms212
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002701.39
LogP ≤ 559.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2-tert-butyl-6-[3-(9,10-diphenylanthracen-2-yl)phenyl]dibenzofuran;6-[3-(9,10-diphenylanthracen-2-yl)phenyl]-2-naphthalen-2-yldibenzofuran;6-[3-(9,10-diphenylanthracen-2-yl)phenyl]-2-phenyldibenzofuran;6-[3-(9,10-diphenylanthracen-2-yl)phenyl]-2-(3-phenylphenyl)dibenzofuran with MolForge

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Related Compounds

8-(2-tert-butyl-10-phenylanthracen-9-yl)naphtho[1,2-b][1]benzofuran;8-(2,6-ditert-butyl-10-phenylanthracen-9-yl)naphtho[1,2-b][1]benzofuran;8-(3,10-diphenylanthracen-9-yl)naphtho[1,2-b][1]benzofuran
CID 158500156
2-tert-butyl-9-naphthalen-2-yl-10-[2-[3-(3-phenylphenyl)phenyl]phenyl]anthracene
CID 58965769
2-(10-naphthalen-2-ylanthracen-9-yl)-6-phenyldibenzofuran
CID 155334995
2-[3-[10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]phenyl]dibenzofuran;2-[3-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]phenyl]dibenzofuran;2-[4-[10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]phenyl]dibenzofuran;2-[4-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]phenyl]dibenzofuran;4-[3-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]phenyl]dibenzofuran;4-[4-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]phenyl]dibenzofuran
CID 161467576
8-(10-naphthalen-2-ylanthracen-9-yl)naphtho[1,2-b][1]benzofuran;8-[3-(10-naphthalen-1-ylanthracen-9-yl)phenyl]naphtho[1,2-b][1]benzofuran;8-(10-phenylanthracen-9-yl)naphtho[1,2-b][1]benzofuran;8-[10-(4-phenylphenyl)anthracen-9-yl]naphtho[1,2-b][1]benzofuran;8-[4-[10-(4-phenylphenyl)anthracen-9-yl]phenyl]naphtho[1,2-b][1]benzofuran
CID 158036336
4-(10-dibenzofuran-4-yl-2-phenanthren-9-ylanthracen-9-yl)dibenzofuran;2-(10-dibenzofuran-2-yl-2-phenylanthracen-9-yl)dibenzofuran;9,10-dinaphthalen-2-yl-2-phenylanthracene;2-(2-phenyl-10-triphenylen-2-ylanthracen-9-yl)triphenylene
CID 158427881
7-[10-(3-dibenzofuran-2-ylphenyl)anthracen-9-yl]-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14,16,18-nonaene;7-[10-(3-dibenzofuran-4-ylphenyl)anthracen-9-yl]-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14,16,18-nonaene;7-[10-(4-naphthalen-2-ylnaphthalen-1-yl)anthracen-9-yl]-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14,16,18-nonaene;7-[10-(4-phenylnaphthalen-1-yl)anthracen-9-yl]-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14,16,18-nonaene;7-[10-(6-phenylnaphthalen-2-yl)anthracen-9-yl]-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14,16,18-nonaene
CID 157181473
2-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]dibenzofuran;2-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]dibenzofuran;4-[2-(10-naphthalen-2-ylanthracen-9-yl)phenyl]dibenzofuran;4-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]dibenzofuran;4-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]dibenzofuran
CID 162126993
4-[4-(2,10-dinaphthalen-2-ylanthracen-9-yl)phenyl]dibenzofuran
CID 58323570
2-tert-butyl-9,10-bis(4-phenylphenyl)anthracene;2-methyl-9,10-bis(4-phenylphenyl)anthracene;2-naphthalen-1-yl-9,10-bis(4-phenylphenyl)anthracene;2-naphthalen-2-yl-9,10-bis(4-phenylphenyl)anthracene;2-phenyl-9,10-bis(4-phenylphenyl)anthracene
CID 158638548
2-[10-[4-(6-deuterionaphthalen-2-yl)phenyl]anthracen-9-yl]-6-phenyldibenzofuran
CID 171449649
6-phenyl-2-[4-(10-phenylanthracen-9-yl)phenyl]dibenzofuran
CID 170187740

Frequently Asked Questions

What is the IUPAC name of 2-tert-butyl-6-[3-(9,10-diphenylanthracen-2-yl)phenyl]dibenzofuran;6-[3-(9,10-diphenylanthracen-2-yl)phenyl]-2-naphthalen-2-yldibenzofuran;6-[3-(9,10-diphenylanthracen-2-yl)phenyl]-2-phenyldibenzofuran;6-[3-(9,10-diphenylanthracen-2-yl)phenyl]-2-(3-phenylphenyl)dibenzofuran?
The IUPAC name of 2-tert-butyl-6-[3-(9,10-diphenylanthracen-2-yl)phenyl]dibenzofuran;6-[3-(9,10-diphenylanthracen-2-yl)phenyl]-2-naphthalen-2-yldibenzofuran;6-[3-(9,10-diphenylanthracen-2-yl)phenyl]-2-phenyldibenzofuran;6-[3-(9,10-diphenylanthracen-2-yl)phenyl]-2-(3-phenylphenyl)dibenzofuran (CID 160998426) is 2-tert-butyl-6-[3-(9,10-diphenylanthracen-2-yl)phenyl]dibenzofuran;6-[3-(9,10-diphenylanthracen-2-yl)phenyl]-2-naphthalen-2-yldibenzofuran;6-[3-(9,10-diphenylanthracen-2-yl)phenyl]-2-phenyldibenzofuran;6-[3-(9,10-diphenylanthracen-2-yl)phenyl]-2-(3-phenylphenyl)dibenzofuran.
What is the SMILES notation for 2-tert-butyl-6-[3-(9,10-diphenylanthracen-2-yl)phenyl]dibenzofuran;6-[3-(9,10-diphenylanthracen-2-yl)phenyl]-2-naphthalen-2-yldibenzofuran;6-[3-(9,10-diphenylanthracen-2-yl)phenyl]-2-phenyldibenzofuran;6-[3-(9,10-diphenylanthracen-2-yl)phenyl]-2-(3-phenylphenyl)dibenzofuran?
The canonical SMILES for 2-tert-butyl-6-[3-(9,10-diphenylanthracen-2-yl)phenyl]dibenzofuran;6-[3-(9,10-diphenylanthracen-2-yl)phenyl]-2-naphthalen-2-yldibenzofuran;6-[3-(9,10-diphenylanthracen-2-yl)phenyl]-2-phenyldibenzofuran;6-[3-(9,10-diphenylanthracen-2-yl)phenyl]-2-(3-phenylphenyl)dibenzofuran is CC(C)(C)c1ccc2oc3c(-c4cccc(-c5ccc6c(-c7ccccc7)c7ccccc7c(-c7ccccc7)c6c5)c4)cccc3c2c1.c1ccc(-c2c3ccccc3c(-c3ccccc3)c3cc(-c4cccc(-c5cccc6c5oc5ccc(-c7ccc8ccccc8c7)cc56)c4)ccc23)cc1.c1ccc(-c2ccc3oc4c(-c5cccc(-c6ccc7c(-c8ccccc8)c8ccccc8c(-c8ccccc8)c7c6)c5)cccc4c3c2)cc1.c1ccc(-c2cccc(-c3ccc4oc5c(-c6cccc(-c7ccc8c(-c9ccccc9)c9ccccc9c(-c9ccccc9)c8c7)c6)cccc5c4c3)c2)cc1.
What is the InChIKey of 2-tert-butyl-6-[3-(9,10-diphenylanthracen-2-yl)phenyl]dibenzofuran;6-[3-(9,10-diphenylanthracen-2-yl)phenyl]-2-naphthalen-2-yldibenzofuran;6-[3-(9,10-diphenylanthracen-2-yl)phenyl]-2-phenyldibenzofuran;6-[3-(9,10-diphenylanthracen-2-yl)phenyl]-2-(3-phenylphenyl)dibenzofuran?
The InChIKey is TVNYNIZTAFHQEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C56H36O.C54H34O.C50H32O.C48H36O/c1-4-15-37(16-5-1)40-21-12-22-41(33-40)44-30-32-53-51(35-44)50-28-14-27-46(56(50)57-53)45-24-13-23-42(34-45)43-29-31-49-52(36-43)55(39-19-8-3-9-20-39)48-26-11-10-25-47(48)54(49)38-17-6-2-7-18-38;1-3-14-36(15-4-1)52-45-21-9-10-22-46(45)53(37-16-5-2-6-17-37)50-34-41(27-29-47(50)52)39-19-11-20-43(32-39)44-23-12-24-48-49-33-42(28-30-51(49)55-54(44)48)40-26-25-35-13-7-8-18-38(35)31-40;1-4-14-33(15-5-1)37-27-29-47-45(31-37)44-25-13-24-40(50(44)51-47)39-21-12-20-36(30-39)38-26-28-43-46(32-38)49(35-18-8-3-9-19-35)42-23-11-10-22-41(42)48(43)34-16-6-2-7-17-34;1-48(2,3)36-25-27-44-42(30-36)41-23-13-22-37(47(41)49-44)35-19-12-18-33(28-35)34-24-26-40-43(29-34)46(32-16-8-5-9-17-32)39-21-11-10-20-38(39)45(40)31-14-6-4-7-15-31/h1-36H;1-34H;1-32H;4-30H,1-3H3.
What are the key properties of 2-tert-butyl-6-[3-(9,10-diphenylanthracen-2-yl)phenyl]dibenzofuran;6-[3-(9,10-diphenylanthracen-2-yl)phenyl]-2-naphthalen-2-yldibenzofuran;6-[3-(9,10-diphenylanthracen-2-yl)phenyl]-2-phenyldibenzofuran;6-[3-(9,10-diphenylanthracen-2-yl)phenyl]-2-(3-phenylphenyl)dibenzofuran?
2-tert-butyl-6-[3-(9,10-diphenylanthracen-2-yl)phenyl]dibenzofuran;6-[3-(9,10-diphenylanthracen-2-yl)phenyl]-2-naphthalen-2-yldibenzofuran;6-[3-(9,10-diphenylanthracen-2-yl)phenyl]-2-phenyldibenzofuran;6-[3-(9,10-diphenylanthracen-2-yl)phenyl]-2-(3-phenylphenyl)dibenzofuran has a molecular weight of 2701.39 g/mol, XLogP of 59.36, 20 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tert-butyl-6-[3-(9,10-diphenylanthracen-2-yl)phenyl]dibenzofuran;6-[3-(9,10-diphenylanthracen-2-yl)phenyl]-2-naphthalen-2-yldibenzofuran;6-[3-(9,10-diphenylanthracen-2-yl)phenyl]-2-phenyldibenzofuran;6-[3-(9,10-diphenylanthracen-2-yl)phenyl]-2-(3-phenylphenyl)dibenzofuran is sourced from PubChem (CID 160998426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).