2-[10-(9,9-dimethylfluoren-3-yl)anthracen-9-yl]dibenzofuran;3-[3-(10-naphthalen-1-ylanthracen-9-yl)phenyl]naphtho[2,1-b][1]benzofuran;3-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]naphtho[2,1-b][1]benzofuran;3-[4-(10-phenylanthracen-9-yl)naphthalen-1-yl]naphtho[2,1-b][1]benzofuran;3-[3-(10-phenylanthracen-9-yl)phenyl]naphtho[2,1-b][1]benzofuran

C221H138O5 — CID 159087704

IUPAC2-[10-(9,9-dimethylfluoren-3-yl)anthracen-9-yl]dibenzofuran;3-[3-(10-naphthalen-1-ylanthracen-9-yl)phenyl]naphtho[2,1-b][1]benzofuran;3-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]naphtho[2,1-b][1]benzofuran;3-[4-(10-phenylanthracen-9-yl)naphthalen-1-yl]naphtho[2,1-b][1]benzofuran;3-[3-(10-phenylanthracen-9-yl)phenyl]naphtho[2,1-b][1]benzofuran
SMILESCC1(C)c2ccccc2-c2cc(-c3c4ccccc4c(-c4ccc5oc6ccccc6c5c4)c4ccccc34)ccc21.c1cc(-c2ccc3c(ccc4oc5ccccc5c43)c2)cc(-c2c3ccccc3c(-c3ccc4ccccc4c3)c3ccccc23)c1.c1cc(-c2ccc3c(ccc4oc5ccccc5c43)c2)cc(-c2c3ccccc3c(-c3cccc4ccccc34)c3ccccc23)c1.c1ccc(-c2c3ccccc3c(-c3ccc(-c4ccc5c(ccc6oc7ccccc7c65)c4)c4ccccc34)c3ccccc23)cc1.c1ccc(-c2c3ccccc3c(-c3cccc(-c4ccc5c(ccc6oc7ccccc7c65)c4)c3)c3ccccc23)cc1
InChIInChI=1S/3C46H28O.C42H26O.C41H28O/c1-2-15-34-29(11-1)12-10-21-36(34)45-39-18-5-3-16-37(39)44(38-17-4-6-19-40(38)45)33-14-9-13-30(28-33)31-23-25-35-32(27-31)24-26-43-46(35)41-20-7-8-22-42(41)47-43;1-2-11-30-27-35(21-20-29(30)10-1)45-39-16-5-3-14-37(39)44(38-15-4-6-17-40(38)45)34-13-9-12-31(28-34)32-22-24-36-33(26-32)23-25-43-46(36)41-18-7-8-19-42(41)47-43;1-2-12-29(13-3-1)44-36-16-6-8-18-38(36)45(39-19-9-7-17-37(39)44)40-26-25-32(34-14-4-5-15-35(34)40)30-22-24-33-31(28-30)23-27-43-46(33)41-20-10-11-21-42(41)47-43;1-2-11-27(12-3-1)40-33-15-4-6-17-35(33)41(36-18-7-5-16-34(36)40)31-14-10-13-28(26-31)29-21-23-32-30(25-29)22-24-39-42(32)37-19-8-9-20-38(37)43-39;1-41(2)35-17-9-7-11-27(35)33-23-25(19-21-36(33)41)39-29-13-3-5-15-31(29)40(32-16-6-4-14-30(32)39)26-20-22-38-34(24-26)28-12-8-10-18-37(28)42-38/h3*1-28H;1-26H;3-24H,1-2H3
InChIKeyKBQQCFWIQVBNNB-UHFFFAOYSA-N
MW2873.53 g/mol
LogP63.18
Rot. Bonds14

About 2-[10-(9,9-dimethylfluoren-3-yl)anthracen-9-yl]dibenzofuran;3-[3-(10-naphthalen-1-ylanthracen-9-yl)phenyl]naphtho[2,1-b][1]benzofuran;3-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]naphtho[2,1-b][1]benzofuran;3-[4-(10-phenylanthracen-9-yl)naphthalen-1-yl]naphtho[2,1-b][1]benzofuran;3-[3-(10-phenylanthracen-9-yl)phenyl]naphtho[2,1-b][1]benzofuran

2-[10-(9,9-dimethylfluoren-3-yl)anthracen-9-yl]dibenzofuran;3-[3-(10-naphthalen-1-ylanthracen-9-yl)phenyl]naphtho[2,1-b][1]benzofuran;3-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]naphtho[2,1-b][1]benzofuran;3-[4-(10-phenylanthracen-9-yl)naphthalen-1-yl]naphtho[2,1-b][1]benzofuran;3-[3-(10-phenylanthracen-9-yl)phenyl]naphtho[2,1-b][1]benzofuran (PubChem CID 159087704) has the molecular formula C221H138O5 and a molecular weight of 2873.53 g/mol. Its IUPAC name is 2-[10-(9,9-dimethylfluoren-3-yl)anthracen-9-yl]dibenzofuran;3-[3-(10-naphthalen-1-ylanthracen-9-yl)phenyl]naphtho[2,1-b][1]benzofuran;3-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]naphtho[2,1-b][1]benzofuran;3-[4-(10-phenylanthracen-9-yl)naphthalen-1-yl]naphtho[2,1-b][1]benzofuran;3-[3-(10-phenylanthracen-9-yl)phenyl]naphtho[2,1-b][1]benzofuran.

Molecular Properties

Compound Name2-[10-(9,9-dimethylfluoren-3-yl)anthracen-9-yl]dibenzofuran;3-[3-(10-naphthalen-1-ylanthracen-9-yl)phenyl]naphtho[2,1-b][1]benzofuran;3-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]naphtho[2,1-b][1]benzofuran;3-[4-(10-phenylanthracen-9-yl)naphthalen-1-yl]naphtho[2,1-b][1]benzofuran;3-[3-(10-phenylanthracen-9-yl)phenyl]naphtho[2,1-b][1]benzofuran
PubChem CID159087704
Molecular FormulaC221H138O5
Molecular Weight2873.53 g/mol
Exact Mass2871.05
IUPAC Name2-[10-(9,9-dimethylfluoren-3-yl)anthracen-9-yl]dibenzofuran;3-[3-(10-naphthalen-1-ylanthracen-9-yl)phenyl]naphtho[2,1-b][1]benzofuran;3-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]naphtho[2,1-b][1]benzofuran;3-[4-(10-phenylanthracen-9-yl)naphthalen-1-yl]naphtho[2,1-b][1]benzofuran;3-[3-(10-phenylanthracen-9-yl)phenyl]naphtho[2,1-b][1]benzofuran
SMILESCC1(C)c2ccccc2-c2cc(-c3c4ccccc4c(-c4ccc5oc6ccccc6c5c4)c4ccccc34)ccc21.c1cc(-c2ccc3c(ccc4oc5ccccc5c43)c2)cc(-c2c3ccccc3c(-c3ccc4ccccc4c3)c3ccccc23)c1.c1cc(-c2ccc3c(ccc4oc5ccccc5c43)c2)cc(-c2c3ccccc3c(-c3cccc4ccccc34)c3ccccc23)c1.c1ccc(-c2c3ccccc3c(-c3ccc(-c4ccc5c(ccc6oc7ccccc7c65)c4)c4ccccc34)c3ccccc23)cc1.c1ccc(-c2c3ccccc3c(-c3cccc(-c4ccc5c(ccc6oc7ccccc7c65)c4)c3)c3ccccc23)cc1
InChIInChI=1S/3C46H28O.C42H26O.C41H28O/c1-2-15-34-29(11-1)12-10-21-36(34)45-39-18-5-3-16-37(39)44(38-17-4-6-19-40(38)45)33-14-9-13-30(28-33)31-23-25-35-32(27-31)24-26-43-46(35)41-20-7-8-22-42(41)47-43;1-2-11-30-27-35(21-20-29(30)10-1)45-39-16-5-3-14-37(39)44(38-15-4-6-17-40(38)45)34-13-9-12-31(28-34)32-22-24-36-33(26-32)23-25-43-46(36)41-18-7-8-19-42(41)47-43;1-2-12-29(13-3-1)44-36-16-6-8-18-38(36)45(39-19-9-7-17-37(39)44)40-26-25-32(34-14-4-5-15-35(34)40)30-22-24-33-31(28-30)23-27-43-46(33)41-20-10-11-21-42(41)47-43;1-2-11-27(12-3-1)40-33-15-4-6-17-35(33)41(36-18-7-5-16-34(36)40)31-14-10-13-28(26-31)29-21-23-32-30(25-29)22-24-39-42(32)37-19-8-9-20-38(37)43-39;1-41(2)35-17-9-7-11-27(35)33-23-25(19-21-36(33)41)39-29-13-3-5-15-31(29)40(32-16-6-4-14-30(32)39)26-20-22-38-34(24-26)28-12-8-10-18-37(28)42-38/h3*1-28H;1-26H;3-24H,1-2H3
InChIKeyKBQQCFWIQVBNNB-UHFFFAOYSA-N
XLogP63.18
TPSA65.70 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds14
Heavy Atoms226
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002873.53
LogP ≤ 563.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 2-[10-(9,9-dimethylfluoren-3-yl)anthracen-9-yl]dibenzofuran;3-[3-(10-naphthalen-1-ylanthracen-9-yl)phenyl]naphtho[2,1-b][1]benzofuran;3-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]naphtho[2,1-b][1]benzofuran;3-[4-(10-phenylanthracen-9-yl)naphthalen-1-yl]naphtho[2,1-b][1]benzofuran;3-[3-(10-phenylanthracen-9-yl)phenyl]naphtho[2,1-b][1]benzofuran with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-[10-(9,9-dimethylfluoren-3-yl)anthracen-9-yl]dibenzofuran;3-[3-(10-naphthalen-1-ylanthracen-9-yl)phenyl]naphtho[2,1-b][1]benzofuran;3-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]naphtho[2,1-b][1]benzofuran;3-[4-(10-phenylanthracen-9-yl)naphthalen-1-yl]naphtho[2,1-b][1]benzofuran;3-[3-(10-phenylanthracen-9-yl)phenyl]naphtho[2,1-b][1]benzofuran?
The IUPAC name of 2-[10-(9,9-dimethylfluoren-3-yl)anthracen-9-yl]dibenzofuran;3-[3-(10-naphthalen-1-ylanthracen-9-yl)phenyl]naphtho[2,1-b][1]benzofuran;3-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]naphtho[2,1-b][1]benzofuran;3-[4-(10-phenylanthracen-9-yl)naphthalen-1-yl]naphtho[2,1-b][1]benzofuran;3-[3-(10-phenylanthracen-9-yl)phenyl]naphtho[2,1-b][1]benzofuran (CID 159087704) is 2-[10-(9,9-dimethylfluoren-3-yl)anthracen-9-yl]dibenzofuran;3-[3-(10-naphthalen-1-ylanthracen-9-yl)phenyl]naphtho[2,1-b][1]benzofuran;3-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]naphtho[2,1-b][1]benzofuran;3-[4-(10-phenylanthracen-9-yl)naphthalen-1-yl]naphtho[2,1-b][1]benzofuran;3-[3-(10-phenylanthracen-9-yl)phenyl]naphtho[2,1-b][1]benzofuran.
What is the SMILES notation for 2-[10-(9,9-dimethylfluoren-3-yl)anthracen-9-yl]dibenzofuran;3-[3-(10-naphthalen-1-ylanthracen-9-yl)phenyl]naphtho[2,1-b][1]benzofuran;3-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]naphtho[2,1-b][1]benzofuran;3-[4-(10-phenylanthracen-9-yl)naphthalen-1-yl]naphtho[2,1-b][1]benzofuran;3-[3-(10-phenylanthracen-9-yl)phenyl]naphtho[2,1-b][1]benzofuran?
The canonical SMILES for 2-[10-(9,9-dimethylfluoren-3-yl)anthracen-9-yl]dibenzofuran;3-[3-(10-naphthalen-1-ylanthracen-9-yl)phenyl]naphtho[2,1-b][1]benzofuran;3-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]naphtho[2,1-b][1]benzofuran;3-[4-(10-phenylanthracen-9-yl)naphthalen-1-yl]naphtho[2,1-b][1]benzofuran;3-[3-(10-phenylanthracen-9-yl)phenyl]naphtho[2,1-b][1]benzofuran is CC1(C)c2ccccc2-c2cc(-c3c4ccccc4c(-c4ccc5oc6ccccc6c5c4)c4ccccc34)ccc21.c1cc(-c2ccc3c(ccc4oc5ccccc5c43)c2)cc(-c2c3ccccc3c(-c3ccc4ccccc4c3)c3ccccc23)c1.c1cc(-c2ccc3c(ccc4oc5ccccc5c43)c2)cc(-c2c3ccccc3c(-c3cccc4ccccc34)c3ccccc23)c1.c1ccc(-c2c3ccccc3c(-c3ccc(-c4ccc5c(ccc6oc7ccccc7c65)c4)c4ccccc34)c3ccccc23)cc1.c1ccc(-c2c3ccccc3c(-c3cccc(-c4ccc5c(ccc6oc7ccccc7c65)c4)c3)c3ccccc23)cc1.
What is the InChIKey of 2-[10-(9,9-dimethylfluoren-3-yl)anthracen-9-yl]dibenzofuran;3-[3-(10-naphthalen-1-ylanthracen-9-yl)phenyl]naphtho[2,1-b][1]benzofuran;3-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]naphtho[2,1-b][1]benzofuran;3-[4-(10-phenylanthracen-9-yl)naphthalen-1-yl]naphtho[2,1-b][1]benzofuran;3-[3-(10-phenylanthracen-9-yl)phenyl]naphtho[2,1-b][1]benzofuran?
The InChIKey is KBQQCFWIQVBNNB-UHFFFAOYSA-N. The full InChI is InChI=1S/3C46H28O.C42H26O.C41H28O/c1-2-15-34-29(11-1)12-10-21-36(34)45-39-18-5-3-16-37(39)44(38-17-4-6-19-40(38)45)33-14-9-13-30(28-33)31-23-25-35-32(27-31)24-26-43-46(35)41-20-7-8-22-42(41)47-43;1-2-11-30-27-35(21-20-29(30)10-1)45-39-16-5-3-14-37(39)44(38-15-4-6-17-40(38)45)34-13-9-12-31(28-34)32-22-24-36-33(26-32)23-25-43-46(36)41-18-7-8-19-42(41)47-43;1-2-12-29(13-3-1)44-36-16-6-8-18-38(36)45(39-19-9-7-17-37(39)44)40-26-25-32(34-14-4-5-15-35(34)40)30-22-24-33-31(28-30)23-27-43-46(33)41-20-10-11-21-42(41)47-43;1-2-11-27(12-3-1)40-33-15-4-6-17-35(33)41(36-18-7-5-16-34(36)40)31-14-10-13-28(26-31)29-21-23-32-30(25-29)22-24-39-42(32)37-19-8-9-20-38(37)43-39;1-41(2)35-17-9-7-11-27(35)33-23-25(19-21-36(33)41)39-29-13-3-5-15-31(29)40(32-16-6-4-14-30(32)39)26-20-22-38-34(24-26)28-12-8-10-18-37(28)42-38/h3*1-28H;1-26H;3-24H,1-2H3.
What are the key properties of 2-[10-(9,9-dimethylfluoren-3-yl)anthracen-9-yl]dibenzofuran;3-[3-(10-naphthalen-1-ylanthracen-9-yl)phenyl]naphtho[2,1-b][1]benzofuran;3-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]naphtho[2,1-b][1]benzofuran;3-[4-(10-phenylanthracen-9-yl)naphthalen-1-yl]naphtho[2,1-b][1]benzofuran;3-[3-(10-phenylanthracen-9-yl)phenyl]naphtho[2,1-b][1]benzofuran?
2-[10-(9,9-dimethylfluoren-3-yl)anthracen-9-yl]dibenzofuran;3-[3-(10-naphthalen-1-ylanthracen-9-yl)phenyl]naphtho[2,1-b][1]benzofuran;3-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]naphtho[2,1-b][1]benzofuran;3-[4-(10-phenylanthracen-9-yl)naphthalen-1-yl]naphtho[2,1-b][1]benzofuran;3-[3-(10-phenylanthracen-9-yl)phenyl]naphtho[2,1-b][1]benzofuran has a molecular weight of 2873.53 g/mol, XLogP of 63.18, 14 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[10-(9,9-dimethylfluoren-3-yl)anthracen-9-yl]dibenzofuran;3-[3-(10-naphthalen-1-ylanthracen-9-yl)phenyl]naphtho[2,1-b][1]benzofuran;3-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]naphtho[2,1-b][1]benzofuran;3-[4-(10-phenylanthracen-9-yl)naphthalen-1-yl]naphtho[2,1-b][1]benzofuran;3-[3-(10-phenylanthracen-9-yl)phenyl]naphtho[2,1-b][1]benzofuran is sourced from PubChem (CID 159087704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).