[7-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]dibenzofuran-2-yl]-triphenylsilane

C60H40OSi — CID 156626209

IUPAC[7-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]dibenzofuran-2-yl]-triphenylsilane
SMILESc1ccc([Si](c2ccccc2)(c2ccccc2)c2ccc3oc4cc(-c5ccc(-c6c7ccccc7c(-c7ccc8ccccc8c7)c7ccccc67)cc5)ccc4c3c2)cc1
InChIInChI=1S/C60H40OSi/c1-4-18-47(19-5-1)62(48-20-6-2-7-21-48,49-22-8-3-9-23-49)50-35-37-57-56(40-50)51-36-34-45(39-58(51)61-57)42-28-31-43(32-29-42)59-52-24-12-14-26-54(52)60(55-27-15-13-25-53(55)59)46-33-30-41-16-10-11-17-44(41)38-46/h1-40H
InChIKeySAAGSKGTKJRRGJ-UHFFFAOYSA-N
MW805.07 g/mol
LogP13.42
Rot. Bonds7

About [7-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]dibenzofuran-2-yl]-triphenylsilane

[7-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]dibenzofuran-2-yl]-triphenylsilane (PubChem CID 156626209) has the molecular formula C60H40OSi and a molecular weight of 805.07 g/mol. Its IUPAC name is [7-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]dibenzofuran-2-yl]-triphenylsilane.

Molecular Properties

Compound Name[7-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]dibenzofuran-2-yl]-triphenylsilane
PubChem CID156626209
Molecular FormulaC60H40OSi
Molecular Weight805.07 g/mol
Exact Mass804.28
IUPAC Name[7-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]dibenzofuran-2-yl]-triphenylsilane
SMILESc1ccc([Si](c2ccccc2)(c2ccccc2)c2ccc3oc4cc(-c5ccc(-c6c7ccccc7c(-c7ccc8ccccc8c7)c7ccccc67)cc5)ccc4c3c2)cc1
InChIInChI=1S/C60H40OSi/c1-4-18-47(19-5-1)62(48-20-6-2-7-21-48,49-22-8-3-9-23-49)50-35-37-57-56(40-50)51-36-34-45(39-58(51)61-57)42-28-31-43(32-29-42)59-52-24-12-14-26-54(52)60(55-27-15-13-25-53(55)59)46-33-30-41-16-10-11-17-44(41)38-46/h1-40H
InChIKeySAAGSKGTKJRRGJ-UHFFFAOYSA-N
XLogP13.42
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms62
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500805.07
LogP ≤ 513.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}, {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

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Related Compounds

2-[4-(10-dibenzofuran-3-ylanthracen-9-yl)phenyl]-7-(10-naphthalen-2-ylanthracen-9-yl)dibenzofuran
CID 174315687
7-naphthalen-2-yl-2-(10-phenylanthracen-9-yl)dibenzofuran;2-(10-phenylanthracen-9-yl)-7-(3-phenylphenyl)dibenzofuran;7-phenyl-2-(10-phenylanthracen-9-yl)dibenzofuran
CID 164972218
(9,10-dinaphthalen-2-ylanthracen-2-yl)-triphenylsilane
CID 59348733
dinaphthalen-2-yl-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]-phenylsilane
CID 123493288
[4-[4-dibenzofuran-2-yl-6-(6-naphthalen-2-ylnaphthalen-2-yl)-1,3,5-triazin-2-yl]phenyl]-triphenylsilane
CID 166569951
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
[9-naphthalen-2-yl-10-(3-naphthalen-2-ylphenyl)-6-triphenylsilylanthracen-2-yl]-triphenylsilane
CID 59348741
19-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]-12,16-dioxahexacyclo[11.11.0.02,11.03,8.015,23.017,22]tetracosa-1(13),2(11),3,5,7,9,14,17(22),18,20,23-undecaene
CID 130190197
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
2-[3-[10-(4-naphthalen-2-ylphenyl)anthracen-9-yl]phenyl]naphtho[2,3-b][1]benzofuran;2-[3-[10-(3-phenylphenyl)anthracen-9-yl]phenyl]naphtho[2,3-b][1]benzofuran
CID 160681067
7-[4-(10-dibenzofuran-2-ylanthracen-9-yl)phenyl]-12-oxapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2(11),3,5,7,9,13,15,17,19-decaene
CID 130188835
2-(2-naphthalen-2-yl-10-naphtho[2,3-b][1]benzofuran-2-ylanthracen-9-yl)naphtho[2,3-b][1]benzofuran
CID 118402714

Frequently Asked Questions

What is the IUPAC name of [7-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]dibenzofuran-2-yl]-triphenylsilane?
The IUPAC name of [7-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]dibenzofuran-2-yl]-triphenylsilane (CID 156626209) is [7-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]dibenzofuran-2-yl]-triphenylsilane.
What is the SMILES notation for [7-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]dibenzofuran-2-yl]-triphenylsilane?
The canonical SMILES for [7-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]dibenzofuran-2-yl]-triphenylsilane is c1ccc([Si](c2ccccc2)(c2ccccc2)c2ccc3oc4cc(-c5ccc(-c6c7ccccc7c(-c7ccc8ccccc8c7)c7ccccc67)cc5)ccc4c3c2)cc1.
What is the InChIKey of [7-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]dibenzofuran-2-yl]-triphenylsilane?
The InChIKey is SAAGSKGTKJRRGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C60H40OSi/c1-4-18-47(19-5-1)62(48-20-6-2-7-21-48,49-22-8-3-9-23-49)50-35-37-57-56(40-50)51-36-34-45(39-58(51)61-57)42-28-31-43(32-29-42)59-52-24-12-14-26-54(52)60(55-27-15-13-25-53(55)59)46-33-30-41-16-10-11-17-44(41)38-46/h1-40H.
What are the key properties of [7-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]dibenzofuran-2-yl]-triphenylsilane?
[7-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]dibenzofuran-2-yl]-triphenylsilane has a molecular weight of 805.07 g/mol, XLogP of 13.42, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [7-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]dibenzofuran-2-yl]-triphenylsilane is sourced from PubChem (CID 156626209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).