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

C192H122O4 — CID 158865776

IUPAC2,8-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
SMILESc1ccc(-c2ccc3cc(-c4ccc5oc6ccc(-c7ccc8cc(-c9ccccc9)ccc8c7)cc6c5c4)ccc3c2)cc1.c1ccc(-c2ccc3ccc(-c4ccc5oc6ccc(-c7ccc8ccc(-c9ccccc9)cc8c7)cc6c5c4)cc3c2)cc1.c1ccc2cc(-c3ccc4cc(-c5ccc6oc7ccc(-c8ccc9cc(-c%10ccc%11ccccc%11c%10)ccc9c8)cc7c6c5)ccc4c3)ccc2c1.c1ccccc(-c2ccc3ccc(-c4ccc5oc6ccc(-c7ccc8ccc(-c9ccc%10ccccc%10c9)cc8c7)cc6c5c4)cc3c2)cccc1
InChIInChI=1S/C52H32O.C52H34O.2C44H28O/c1-3-7-35-25-37(11-9-33(35)5-1)39-13-15-43-29-45(19-17-41(43)27-39)47-21-23-51-49(31-47)50-32-48(22-24-52(50)53-51)46-20-18-42-28-40(14-16-44(42)30-46)38-12-10-34-6-2-4-8-36(34)26-38;1-2-4-6-10-35(11-7-5-3-1)40-19-15-37-17-22-43(31-47(37)29-40)45-24-26-51-49(33-45)50-34-46(25-27-52(50)53-51)44-23-18-38-16-21-42(30-48(38)32-44)41-20-14-36-12-8-9-13-39(36)28-41;1-3-7-29(8-4-1)33-15-11-31-13-17-35(25-39(31)23-33)37-19-21-43-41(27-37)42-28-38(20-22-44(42)45-43)36-18-14-32-12-16-34(24-40(32)26-36)30-9-5-2-6-10-30;1-3-7-29(8-4-1)31-11-13-35-25-37(17-15-33(35)23-31)39-19-21-43-41(27-39)42-28-40(20-22-44(42)45-43)38-18-16-34-24-32(12-14-36(34)26-38)30-9-5-2-6-10-30/h1-32H;1-34H;2*1-28H/b;2-1-,3-1-,4-2-,5-3+,6-4+,7-5+,10-6+,11-7-,35-10+,35-11+;;
InChIKeyJBFFBUGUFNDTSD-NNKKETCXSA-N
MW2493.08 g/mol
LogP54.83
Rot. Bonds16

About 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

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 (PubChem CID 158865776) has the molecular formula C192H122O4 and a molecular weight of 2493.08 g/mol. Its IUPAC name is 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.

Molecular Properties

Compound Name2,8-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
PubChem CID158865776
Molecular FormulaC192H122O4
Molecular Weight2493.08 g/mol
Exact Mass2490.93
IUPAC Name2,8-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
SMILESc1ccc(-c2ccc3cc(-c4ccc5oc6ccc(-c7ccc8cc(-c9ccccc9)ccc8c7)cc6c5c4)ccc3c2)cc1.c1ccc(-c2ccc3ccc(-c4ccc5oc6ccc(-c7ccc8ccc(-c9ccccc9)cc8c7)cc6c5c4)cc3c2)cc1.c1ccc2cc(-c3ccc4cc(-c5ccc6oc7ccc(-c8ccc9cc(-c%10ccc%11ccccc%11c%10)ccc9c8)cc7c6c5)ccc4c3)ccc2c1.c1ccccc(-c2ccc3ccc(-c4ccc5oc6ccc(-c7ccc8ccc(-c9ccc%10ccccc%10c9)cc8c7)cc6c5c4)cc3c2)cccc1
InChIInChI=1S/C52H32O.C52H34O.2C44H28O/c1-3-7-35-25-37(11-9-33(35)5-1)39-13-15-43-29-45(19-17-41(43)27-39)47-21-23-51-49(31-47)50-32-48(22-24-52(50)53-51)46-20-18-42-28-40(14-16-44(42)30-46)38-12-10-34-6-2-4-8-36(34)26-38;1-2-4-6-10-35(11-7-5-3-1)40-19-15-37-17-22-43(31-47(37)29-40)45-24-26-51-49(33-45)50-34-46(25-27-52(50)53-51)44-23-18-38-16-21-42(30-48(38)32-44)41-20-14-36-12-8-9-13-39(36)28-41;1-3-7-29(8-4-1)33-15-11-31-13-17-35(25-39(31)23-33)37-19-21-43-41(27-37)42-28-38(20-22-44(42)45-43)36-18-14-32-12-16-34(24-40(32)26-36)30-9-5-2-6-10-30;1-3-7-29(8-4-1)31-11-13-35-25-37(17-15-33(35)23-31)39-19-21-43-41(27-39)42-28-40(20-22-44(42)45-43)38-18-16-34-24-32(12-14-36(34)26-38)30-9-5-2-6-10-30/h1-32H;1-34H;2*1-28H/b;2-1-,3-1-,4-2-,5-3+,6-4+,7-5+,10-6+,11-7-,35-10+,35-11+;;
InChIKeyJBFFBUGUFNDTSD-NNKKETCXSA-N
XLogP54.83
TPSA52.56 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds16
Heavy Atoms196
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002493.08
LogP ≤ 554.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 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 with MolForge

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Frequently Asked Questions

What is the IUPAC name of 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?
The IUPAC name of 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) is 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.
What is the SMILES notation for 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?
The canonical SMILES for 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 is c1ccc(-c2ccc3cc(-c4ccc5oc6ccc(-c7ccc8cc(-c9ccccc9)ccc8c7)cc6c5c4)ccc3c2)cc1.c1ccc(-c2ccc3ccc(-c4ccc5oc6ccc(-c7ccc8ccc(-c9ccccc9)cc8c7)cc6c5c4)cc3c2)cc1.c1ccc2cc(-c3ccc4cc(-c5ccc6oc7ccc(-c8ccc9cc(-c%10ccc%11ccccc%11c%10)ccc9c8)cc7c6c5)ccc4c3)ccc2c1.c1ccccc(-c2ccc3ccc(-c4ccc5oc6ccc(-c7ccc8ccc(-c9ccc%10ccccc%10c9)cc8c7)cc6c5c4)cc3c2)cccc1.
What is the InChIKey of 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?
The InChIKey is JBFFBUGUFNDTSD-NNKKETCXSA-N. The full InChI is InChI=1S/C52H32O.C52H34O.2C44H28O/c1-3-7-35-25-37(11-9-33(35)5-1)39-13-15-43-29-45(19-17-41(43)27-39)47-21-23-51-49(31-47)50-32-48(22-24-52(50)53-51)46-20-18-42-28-40(14-16-44(42)30-46)38-12-10-34-6-2-4-8-36(34)26-38;1-2-4-6-10-35(11-7-5-3-1)40-19-15-37-17-22-43(31-47(37)29-40)45-24-26-51-49(33-45)50-34-46(25-27-52(50)53-51)44-23-18-38-16-21-42(30-48(38)32-44)41-20-14-36-12-8-9-13-39(36)28-41;1-3-7-29(8-4-1)33-15-11-31-13-17-35(25-39(31)23-33)37-19-21-43-41(27-37)42-28-38(20-22-44(42)45-43)36-18-14-32-12-16-34(24-40(32)26-36)30-9-5-2-6-10-30;1-3-7-29(8-4-1)31-11-13-35-25-37(17-15-33(35)23-31)39-19-21-43-41(27-39)42-28-40(20-22-44(42)45-43)38-18-16-34-24-32(12-14-36(34)26-38)30-9-5-2-6-10-30/h1-32H;1-34H;2*1-28H/b;2-1-,3-1-,4-2-,5-3+,6-4+,7-5+,10-6+,11-7-,35-10+,35-11+;;.
What are the key properties of 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?
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 has a molecular weight of 2493.08 g/mol, XLogP of 54.83, 16 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 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 is sourced from PubChem (CID 158865776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).