[3,5-di(carbazol-9-yl)phenyl]-triphenylsilane

C48H34N2Si — CID 53427855

IUPAC[3,5-di(carbazol-9-yl)phenyl]-triphenylsilane
SMILESc1ccc([Si](c2ccccc2)(c2ccccc2)c2cc(-n3c4ccccc4c4ccccc43)cc(-n3c4ccccc4c4ccccc43)c2)cc1
InChIInChI=1S/C48H34N2Si/c1-4-18-37(19-5-1)51(38-20-6-2-7-21-38,39-22-8-3-9-23-39)40-33-35(49-45-28-14-10-24-41(45)42-25-11-15-29-46(42)49)32-36(34-40)50-47-30-16-12-26-43(47)44-27-13-17-31-48(44)50/h1-34H
InChIKeyGWFGARXUJNKOMY-UHFFFAOYSA-N
MW666.90 g/mol
LogP9.26
Rot. Bonds6

About [3,5-di(carbazol-9-yl)phenyl]-triphenylsilane

[3,5-di(carbazol-9-yl)phenyl]-triphenylsilane (PubChem CID 53427855) has the molecular formula C48H34N2Si and a molecular weight of 666.90 g/mol. Its IUPAC name is [3,5-di(carbazol-9-yl)phenyl]-triphenylsilane.

Molecular Properties

Compound Name[3,5-di(carbazol-9-yl)phenyl]-triphenylsilane
PubChem CID53427855
Molecular FormulaC48H34N2Si
Molecular Weight666.90 g/mol
Exact Mass666.25
IUPAC Name[3,5-di(carbazol-9-yl)phenyl]-triphenylsilane
SMILESc1ccc([Si](c2ccccc2)(c2ccccc2)c2cc(-n3c4ccccc4c4ccccc43)cc(-n3c4ccccc4c4ccccc43)c2)cc1
InChIInChI=1S/C48H34N2Si/c1-4-18-37(19-5-1)51(38-20-6-2-7-21-38,39-22-8-3-9-23-39)40-33-35(49-45-28-14-10-24-41(45)42-25-11-15-29-46(42)49)32-36(34-40)50-47-30-16-12-26-43(47)44-27-13-17-31-48(44)50/h1-34H
InChIKeyGWFGARXUJNKOMY-UHFFFAOYSA-N
XLogP9.26
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms51
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500666.90
LogP ≤ 59.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(3-carbazol-9-ylphenyl)-triphenylsilane
CID 58926933
bis(4-carbazol-9-ylphenyl)-diphenylsilane
CID 139043550
triphenyl-[3-(11-phenylindolo[2,3-a]carbazol-12-yl)-5-triphenylsilylphenyl]silane
CID 168792001
[3-bromo-5-(3-carbazol-9-ylcarbazol-9-yl)phenyl]-triphenylsilane
CID 162490214
[3,5-di(carbazol-9-yl)phenyl]-diphenyl-(9-phenylcarbazol-4-yl)silane
CID 158933010
[4-[3,6-di(carbazol-9-yl)carbazol-9-yl]phenyl]-triphenylsilane
CID 159773868
[3,5-di(carbazol-9-yl)-2,6-dideuteriophenyl]-[3,5-di(carbazol-9-yl)-2,4,6-trideuteriophenyl]-diphenylsilane
CID 59844832
triphenyl-[3-[2-[2-(2-triphenylsilylcarbazol-9-yl)carbazol-9-yl]carbazol-9-yl]phenyl]silane
CID 166588700
triphenyl-[3-[12-(3-triphenylsilylphenyl)indolo[2,3-a]carbazol-11-yl]phenyl]silane
CID 168792006
diphenyl-(9-phenylcarbazol-2-yl)-[3-(5-phenylindolo[3,2-b]carbazol-11-yl)phenyl]silane
CID 140842640
9-[3,5-di(carbazol-9-yl)phenyl]carbazole;molecular hydrogen
CID 160506495
diphenyl-(9-phenylcarbazol-3-yl)-[9-(9-phenylcarbazol-3-yl)carbazol-3-yl]silane
CID 89393751

Frequently Asked Questions

What is the IUPAC name of [3,5-di(carbazol-9-yl)phenyl]-triphenylsilane?
The IUPAC name of [3,5-di(carbazol-9-yl)phenyl]-triphenylsilane (CID 53427855) is [3,5-di(carbazol-9-yl)phenyl]-triphenylsilane.
What is the SMILES notation for [3,5-di(carbazol-9-yl)phenyl]-triphenylsilane?
The canonical SMILES for [3,5-di(carbazol-9-yl)phenyl]-triphenylsilane is c1ccc([Si](c2ccccc2)(c2ccccc2)c2cc(-n3c4ccccc4c4ccccc43)cc(-n3c4ccccc4c4ccccc43)c2)cc1.
What is the InChIKey of [3,5-di(carbazol-9-yl)phenyl]-triphenylsilane?
The InChIKey is GWFGARXUJNKOMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H34N2Si/c1-4-18-37(19-5-1)51(38-20-6-2-7-21-38,39-22-8-3-9-23-39)40-33-35(49-45-28-14-10-24-41(45)42-25-11-15-29-46(42)49)32-36(34-40)50-47-30-16-12-26-43(47)44-27-13-17-31-48(44)50/h1-34H.
What are the key properties of [3,5-di(carbazol-9-yl)phenyl]-triphenylsilane?
[3,5-di(carbazol-9-yl)phenyl]-triphenylsilane has a molecular weight of 666.90 g/mol, XLogP of 9.26, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3,5-di(carbazol-9-yl)phenyl]-triphenylsilane is sourced from PubChem (CID 53427855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).