9-dibenzofuran-2-yl-10-naphthalen-2-ylanthracene-1,2,3,4,5,6,7,8-octol;9-dibenzofuran-2-yl-10-(6-phenylnaphthalen-2-yl)anthracene-1,2,3,4,5,6,7,8-octol;9-dibenzofuran-2-yl-10-[2-(4-phenylphenyl)phenyl]anthracene-1,2,3,4,5,6,7,8-octol

C122H76O27 — CID 167694750

IUPAC9-dibenzofuran-2-yl-10-naphthalen-2-ylanthracene-1,2,3,4,5,6,7,8-octol;9-dibenzofuran-2-yl-10-(6-phenylnaphthalen-2-yl)anthracene-1,2,3,4,5,6,7,8-octol;9-dibenzofuran-2-yl-10-[2-(4-phenylphenyl)phenyl]anthracene-1,2,3,4,5,6,7,8-octol
SMILESOc1c(O)c(O)c2c(-c3ccc4oc5ccccc5c4c3)c3c(O)c(O)c(O)c(O)c3c(-c3ccc4cc(-c5ccccc5)ccc4c3)c2c1O.Oc1c(O)c(O)c2c(-c3ccc4oc5ccccc5c4c3)c3c(O)c(O)c(O)c(O)c3c(-c3ccc4ccccc4c3)c2c1O.Oc1c(O)c(O)c2c(-c3ccccc3-c3ccc(-c4ccccc4)cc3)c3c(O)c(O)c(O)c(O)c3c(-c3ccc4oc5ccccc5c4c3)c2c1O
InChIInChI=1S/C44H28O9.C42H26O9.C36H22O9/c45-37-33-31(24-18-19-30-28(20-24)26-11-6-7-13-29(26)53-30)34-36(40(48)44(52)42(50)38(34)46)32(35(33)39(47)43(51)41(37)49)27-12-5-4-10-25(27)23-16-14-22(15-17-23)21-8-2-1-3-9-21;43-35-31-29(23-13-12-21-16-20(10-11-22(21)17-23)19-6-2-1-3-7-19)32-34(38(46)42(50)40(48)36(32)44)30(33(31)37(45)41(49)39(35)47)24-14-15-28-26(18-24)25-8-4-5-9-27(25)51-28;37-29-25-23(17-10-9-15-5-1-2-6-16(15)13-17)26-28(32(40)36(44)34(42)30(26)38)24(27(25)31(39)35(43)33(29)41)18-11-12-22-20(14-18)19-7-3-4-8-21(19)45-22/h1-20,45-52H;1-18,43-50H;1-14,37-44H
InChIKeyXMEBOBSARBPEPO-UHFFFAOYSA-N
MW1973.92 g/mol
LogP27.92
Rot. Bonds9

About 9-dibenzofuran-2-yl-10-naphthalen-2-ylanthracene-1,2,3,4,5,6,7,8-octol;9-dibenzofuran-2-yl-10-(6-phenylnaphthalen-2-yl)anthracene-1,2,3,4,5,6,7,8-octol;9-dibenzofuran-2-yl-10-[2-(4-phenylphenyl)phenyl]anthracene-1,2,3,4,5,6,7,8-octol

9-dibenzofuran-2-yl-10-naphthalen-2-ylanthracene-1,2,3,4,5,6,7,8-octol;9-dibenzofuran-2-yl-10-(6-phenylnaphthalen-2-yl)anthracene-1,2,3,4,5,6,7,8-octol;9-dibenzofuran-2-yl-10-[2-(4-phenylphenyl)phenyl]anthracene-1,2,3,4,5,6,7,8-octol (PubChem CID 167694750) has the molecular formula C122H76O27 and a molecular weight of 1973.92 g/mol. Its IUPAC name is 9-dibenzofuran-2-yl-10-naphthalen-2-ylanthracene-1,2,3,4,5,6,7,8-octol;9-dibenzofuran-2-yl-10-(6-phenylnaphthalen-2-yl)anthracene-1,2,3,4,5,6,7,8-octol;9-dibenzofuran-2-yl-10-[2-(4-phenylphenyl)phenyl]anthracene-1,2,3,4,5,6,7,8-octol.

Molecular Properties

Compound Name9-dibenzofuran-2-yl-10-naphthalen-2-ylanthracene-1,2,3,4,5,6,7,8-octol;9-dibenzofuran-2-yl-10-(6-phenylnaphthalen-2-yl)anthracene-1,2,3,4,5,6,7,8-octol;9-dibenzofuran-2-yl-10-[2-(4-phenylphenyl)phenyl]anthracene-1,2,3,4,5,6,7,8-octol
PubChem CID167694750
Molecular FormulaC122H76O27
Molecular Weight1973.92 g/mol
Exact Mass1972.46
IUPAC Name9-dibenzofuran-2-yl-10-naphthalen-2-ylanthracene-1,2,3,4,5,6,7,8-octol;9-dibenzofuran-2-yl-10-(6-phenylnaphthalen-2-yl)anthracene-1,2,3,4,5,6,7,8-octol;9-dibenzofuran-2-yl-10-[2-(4-phenylphenyl)phenyl]anthracene-1,2,3,4,5,6,7,8-octol
SMILESOc1c(O)c(O)c2c(-c3ccc4oc5ccccc5c4c3)c3c(O)c(O)c(O)c(O)c3c(-c3ccc4cc(-c5ccccc5)ccc4c3)c2c1O.Oc1c(O)c(O)c2c(-c3ccc4oc5ccccc5c4c3)c3c(O)c(O)c(O)c(O)c3c(-c3ccc4ccccc4c3)c2c1O.Oc1c(O)c(O)c2c(-c3ccccc3-c3ccc(-c4ccccc4)cc3)c3c(O)c(O)c(O)c(O)c3c(-c3ccc4oc5ccccc5c4c3)c2c1O
InChIInChI=1S/C44H28O9.C42H26O9.C36H22O9/c45-37-33-31(24-18-19-30-28(20-24)26-11-6-7-13-29(26)53-30)34-36(40(48)44(52)42(50)38(34)46)32(35(33)39(47)43(51)41(37)49)27-12-5-4-10-25(27)23-16-14-22(15-17-23)21-8-2-1-3-9-21;43-35-31-29(23-13-12-21-16-20(10-11-22(21)17-23)19-6-2-1-3-7-19)32-34(38(46)42(50)40(48)36(32)44)30(33(31)37(45)41(49)39(35)47)24-14-15-28-26(18-24)25-8-4-5-9-27(25)51-28;37-29-25-23(17-10-9-15-5-1-2-6-16(15)13-17)26-28(32(40)36(44)34(42)30(26)38)24(27(25)31(39)35(43)33(29)41)18-11-12-22-20(14-18)19-7-3-4-8-21(19)45-22/h1-20,45-52H;1-18,43-50H;1-14,37-44H
InChIKeyXMEBOBSARBPEPO-UHFFFAOYSA-N
XLogP27.92
TPSA524.94 Ų
H-Bond Donors24
H-Bond Acceptors27
Rotatable Bonds9
Heavy Atoms149
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001973.92
LogP ≤ 527.92
H-Bond Donors ≤ 524
H-Bond Acceptors ≤ 1027

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'catechol_A(92)', 'substructure': 'N/A'}, {'alert_name': 'catechol', 'substructure': 'N/A'}, {'alert_name': 'hydroquinone', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

Analyze 9-dibenzofuran-2-yl-10-naphthalen-2-ylanthracene-1,2,3,4,5,6,7,8-octol;9-dibenzofuran-2-yl-10-(6-phenylnaphthalen-2-yl)anthracene-1,2,3,4,5,6,7,8-octol;9-dibenzofuran-2-yl-10-[2-(4-phenylphenyl)phenyl]anthracene-1,2,3,4,5,6,7,8-octol with MolForge

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Related Compounds

CID 170723482
CID 170723482
9-dibenzofuran-2-yl-10-(3,5-diphenylphenyl)anthracene-1,2,3,4,5,6,7,8-octol
CID 158620166
N-(4-dibenzofuran-2-ylphenyl)-4-(3-naphthalen-2-ylphenyl)-N-[4-(2-phenylphenyl)phenyl]aniline
CID 166566167
2-[2-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]phenyl]dibenzofuran
CID 174296945
2-[2-[10-(2-naphthalen-2-ylphenyl)anthracen-9-yl]phenyl]dibenzofuran
CID 58536112
9-(4-dibenzofuran-4-ylphenyl)-10-naphthalen-2-ylanthracene-1,2,3,4,5,6,7,8-octol
CID 163590841
9-naphtho[2,3-b][1]benzofuran-1-yl-10-[2-(4-phenylphenyl)phenyl]anthracene-1,2,3,4,5,6,7,8-octol
CID 158025600
9-(3-naphthalen-2-ylphenyl)-10-(3-phenylphenyl)anthracene;9-(4-naphthalen-2-ylphenyl)-10-(3-phenylphenyl)anthracene;2-[3-[10-(4-phenylphenyl)anthracen-9-yl]phenyl]dibenzofuran
CID 165028790
2-(10-naphthalen-2-ylanthracen-9-yl)dibenzofuran;2-[10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]dibenzofuran;2-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]dibenzofuran;2-(10-phenanthren-9-ylanthracen-9-yl)dibenzofuran;2-[10-(2-phenylphenyl)anthracen-9-yl]dibenzofuran;2-[10-(3-phenylphenyl)anthracen-9-yl]dibenzofuran
CID 160678336
9-naphthalen-1-yl-10-naphtho[2,3-b][1]benzofuran-2-ylanthracene-1,2,3,4,5,6,7,8-octol
CID 160732184
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
9-dibenzofuran-2-yl-10-dibenzofuran-4-ylanthracene-1,2,3,4,5,6,7,8-octol
CID 163557870

Frequently Asked Questions

What is the IUPAC name of 9-dibenzofuran-2-yl-10-naphthalen-2-ylanthracene-1,2,3,4,5,6,7,8-octol;9-dibenzofuran-2-yl-10-(6-phenylnaphthalen-2-yl)anthracene-1,2,3,4,5,6,7,8-octol;9-dibenzofuran-2-yl-10-[2-(4-phenylphenyl)phenyl]anthracene-1,2,3,4,5,6,7,8-octol?
The IUPAC name of 9-dibenzofuran-2-yl-10-naphthalen-2-ylanthracene-1,2,3,4,5,6,7,8-octol;9-dibenzofuran-2-yl-10-(6-phenylnaphthalen-2-yl)anthracene-1,2,3,4,5,6,7,8-octol;9-dibenzofuran-2-yl-10-[2-(4-phenylphenyl)phenyl]anthracene-1,2,3,4,5,6,7,8-octol (CID 167694750) is 9-dibenzofuran-2-yl-10-naphthalen-2-ylanthracene-1,2,3,4,5,6,7,8-octol;9-dibenzofuran-2-yl-10-(6-phenylnaphthalen-2-yl)anthracene-1,2,3,4,5,6,7,8-octol;9-dibenzofuran-2-yl-10-[2-(4-phenylphenyl)phenyl]anthracene-1,2,3,4,5,6,7,8-octol.
What is the SMILES notation for 9-dibenzofuran-2-yl-10-naphthalen-2-ylanthracene-1,2,3,4,5,6,7,8-octol;9-dibenzofuran-2-yl-10-(6-phenylnaphthalen-2-yl)anthracene-1,2,3,4,5,6,7,8-octol;9-dibenzofuran-2-yl-10-[2-(4-phenylphenyl)phenyl]anthracene-1,2,3,4,5,6,7,8-octol?
The canonical SMILES for 9-dibenzofuran-2-yl-10-naphthalen-2-ylanthracene-1,2,3,4,5,6,7,8-octol;9-dibenzofuran-2-yl-10-(6-phenylnaphthalen-2-yl)anthracene-1,2,3,4,5,6,7,8-octol;9-dibenzofuran-2-yl-10-[2-(4-phenylphenyl)phenyl]anthracene-1,2,3,4,5,6,7,8-octol is Oc1c(O)c(O)c2c(-c3ccc4oc5ccccc5c4c3)c3c(O)c(O)c(O)c(O)c3c(-c3ccc4cc(-c5ccccc5)ccc4c3)c2c1O.Oc1c(O)c(O)c2c(-c3ccc4oc5ccccc5c4c3)c3c(O)c(O)c(O)c(O)c3c(-c3ccc4ccccc4c3)c2c1O.Oc1c(O)c(O)c2c(-c3ccccc3-c3ccc(-c4ccccc4)cc3)c3c(O)c(O)c(O)c(O)c3c(-c3ccc4oc5ccccc5c4c3)c2c1O.
What is the InChIKey of 9-dibenzofuran-2-yl-10-naphthalen-2-ylanthracene-1,2,3,4,5,6,7,8-octol;9-dibenzofuran-2-yl-10-(6-phenylnaphthalen-2-yl)anthracene-1,2,3,4,5,6,7,8-octol;9-dibenzofuran-2-yl-10-[2-(4-phenylphenyl)phenyl]anthracene-1,2,3,4,5,6,7,8-octol?
The InChIKey is XMEBOBSARBPEPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C44H28O9.C42H26O9.C36H22O9/c45-37-33-31(24-18-19-30-28(20-24)26-11-6-7-13-29(26)53-30)34-36(40(48)44(52)42(50)38(34)46)32(35(33)39(47)43(51)41(37)49)27-12-5-4-10-25(27)23-16-14-22(15-17-23)21-8-2-1-3-9-21;43-35-31-29(23-13-12-21-16-20(10-11-22(21)17-23)19-6-2-1-3-7-19)32-34(38(46)42(50)40(48)36(32)44)30(33(31)37(45)41(49)39(35)47)24-14-15-28-26(18-24)25-8-4-5-9-27(25)51-28;37-29-25-23(17-10-9-15-5-1-2-6-16(15)13-17)26-28(32(40)36(44)34(42)30(26)38)24(27(25)31(39)35(43)33(29)41)18-11-12-22-20(14-18)19-7-3-4-8-21(19)45-22/h1-20,45-52H;1-18,43-50H;1-14,37-44H.
What are the key properties of 9-dibenzofuran-2-yl-10-naphthalen-2-ylanthracene-1,2,3,4,5,6,7,8-octol;9-dibenzofuran-2-yl-10-(6-phenylnaphthalen-2-yl)anthracene-1,2,3,4,5,6,7,8-octol;9-dibenzofuran-2-yl-10-[2-(4-phenylphenyl)phenyl]anthracene-1,2,3,4,5,6,7,8-octol?
9-dibenzofuran-2-yl-10-naphthalen-2-ylanthracene-1,2,3,4,5,6,7,8-octol;9-dibenzofuran-2-yl-10-(6-phenylnaphthalen-2-yl)anthracene-1,2,3,4,5,6,7,8-octol;9-dibenzofuran-2-yl-10-[2-(4-phenylphenyl)phenyl]anthracene-1,2,3,4,5,6,7,8-octol has a molecular weight of 1973.92 g/mol, XLogP of 27.92, 9 rotatable bonds, 24 hydrogen bond donors, and 27 hydrogen bond acceptors.
Where does this data come from?
All data for 9-dibenzofuran-2-yl-10-naphthalen-2-ylanthracene-1,2,3,4,5,6,7,8-octol;9-dibenzofuran-2-yl-10-(6-phenylnaphthalen-2-yl)anthracene-1,2,3,4,5,6,7,8-octol;9-dibenzofuran-2-yl-10-[2-(4-phenylphenyl)phenyl]anthracene-1,2,3,4,5,6,7,8-octol is sourced from PubChem (CID 167694750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).