[2-(3-carbazol-9-ylcarbazol-9-yl)-4-triphenylsilylphenyl]-triphenylsilane

C66H48N2Si2 — CID 177105255

IUPAC[2-(3-carbazol-9-ylcarbazol-9-yl)-4-triphenylsilylphenyl]-triphenylsilane
SMILESc1ccc([Si](c2ccccc2)(c2ccccc2)c2ccc([Si](c3ccccc3)(c3ccccc3)c3ccccc3)c(-n3c4ccccc4c4cc(-n5c6ccccc6c6ccccc65)ccc43)c2)cc1
InChIInChI=1S/C66H48N2Si2/c1-7-25-50(26-8-1)69(51-27-9-2-10-28-51,52-29-11-3-12-30-52)56-44-46-66(70(53-31-13-4-14-32-53,54-33-15-5-16-34-54)55-35-17-6-18-36-55)65(48-56)68-63-42-24-21-39-59(63)60-47-49(43-45-64(60)68)67-61-40-22-19-37-57(61)58-38-20-23-41-62(58)67/h1-48H
InChIKeyMDSRPZLKQQEJHC-UHFFFAOYSA-N
MW925.30 g/mol
LogP10.64
Rot. Bonds10

About [2-(3-carbazol-9-ylcarbazol-9-yl)-4-triphenylsilylphenyl]-triphenylsilane

[2-(3-carbazol-9-ylcarbazol-9-yl)-4-triphenylsilylphenyl]-triphenylsilane (PubChem CID 177105255) has the molecular formula C66H48N2Si2 and a molecular weight of 925.30 g/mol. Its IUPAC name is [2-(3-carbazol-9-ylcarbazol-9-yl)-4-triphenylsilylphenyl]-triphenylsilane.

Molecular Properties

Compound Name[2-(3-carbazol-9-ylcarbazol-9-yl)-4-triphenylsilylphenyl]-triphenylsilane
PubChem CID177105255
Molecular FormulaC66H48N2Si2
Molecular Weight925.30 g/mol
Exact Mass924.34
IUPAC Name[2-(3-carbazol-9-ylcarbazol-9-yl)-4-triphenylsilylphenyl]-triphenylsilane
SMILESc1ccc([Si](c2ccccc2)(c2ccccc2)c2ccc([Si](c3ccccc3)(c3ccccc3)c3ccccc3)c(-n3c4ccccc4c4cc(-n5c6ccccc6c6ccccc65)ccc43)c2)cc1
InChIInChI=1S/C66H48N2Si2/c1-7-25-50(26-8-1)69(51-27-9-2-10-28-51,52-29-11-3-12-30-52)56-44-46-66(70(53-31-13-4-14-32-53,54-33-15-5-16-34-54)55-35-17-6-18-36-55)65(48-56)68-63-42-24-21-39-59(63)60-47-49(43-45-64(60)68)67-61-40-22-19-37-57(61)58-38-20-23-41-62(58)67/h1-48H
InChIKeyMDSRPZLKQQEJHC-UHFFFAOYSA-N
XLogP10.64
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms70
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500925.30
LogP ≤ 510.64
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

[2-(3-carbazol-9-ylcarbazol-9-yl)-5-triphenylsilylphenyl]-triphenylsilane
CID 177105259
[4-[3,6-di(carbazol-9-yl)carbazol-9-yl]phenyl]-triphenylsilane
CID 159773868
diphenyl-(9-phenylcarbazol-3-yl)-[9-(9-phenylcarbazol-3-yl)carbazol-3-yl]silane
CID 89393751
[7-carbazol-9-yl-9-(9-phenylcarbazol-3-yl)carbazol-2-yl]-triphenylsilane
CID 170516315
triphenyl-[3-[3-[1-(3-triphenylsilylcarbazol-9-yl)carbazol-9-yl]carbazol-9-yl]phenyl]silane
CID 166588869
[9-[2-[2-[3-(3-methylcarbazol-9-yl)carbazol-9-yl]phenyl]phenyl]carbazol-3-yl]-triphenylsilane
CID 174139185
[3-[4-carbazol-9-yl-3-(3-carbazol-9-ylcarbazol-9-yl)carbazol-9-yl]phenyl]-triphenylsilane
CID 171405539
[9-[2-carbazol-9-yl-6-(3-carbazol-9-ylcarbazol-9-yl)-4-pyridinyl]carbazol-3-yl]-triphenylsilane
CID 169052984
[3-(3-carbazol-9-ylcarbazol-9-yl)phenyl]-triphenylsilane;[3-(3-carbazol-9-yl-6-trimethylsilylcarbazol-9-yl)phenyl]-triphenylsilane;[3-(3-carbazol-9-yl-6-triphenylsilylcarbazol-9-yl)phenyl]-triphenylsilane
CID 165013153
[2-carbazol-9-yl-9-(9-phenylcarbazol-2-yl)carbazol-3-yl]-triphenylsilane
CID 170516488
(30-carbazol-9-yl-8,26-diazanonacyclo[24.10.1.18,15.02,7.09,14.020,25.027,32.033,37.019,38]octatriaconta-1(37),2,4,6,9(14),10,12,15,17,19(38),20,22,24,27(32),28,30,33,35-octadecaen-12-yl)-triphenylsilane
CID 168811390
[9-[6-carbazol-9-yl-2-(3-carbazol-9-ylcarbazol-9-yl)-3-pyridinyl]carbazol-3-yl]-triphenylsilane
CID 169052949

Frequently Asked Questions

What is the IUPAC name of [2-(3-carbazol-9-ylcarbazol-9-yl)-4-triphenylsilylphenyl]-triphenylsilane?
The IUPAC name of [2-(3-carbazol-9-ylcarbazol-9-yl)-4-triphenylsilylphenyl]-triphenylsilane (CID 177105255) is [2-(3-carbazol-9-ylcarbazol-9-yl)-4-triphenylsilylphenyl]-triphenylsilane.
What is the SMILES notation for [2-(3-carbazol-9-ylcarbazol-9-yl)-4-triphenylsilylphenyl]-triphenylsilane?
The canonical SMILES for [2-(3-carbazol-9-ylcarbazol-9-yl)-4-triphenylsilylphenyl]-triphenylsilane is c1ccc([Si](c2ccccc2)(c2ccccc2)c2ccc([Si](c3ccccc3)(c3ccccc3)c3ccccc3)c(-n3c4ccccc4c4cc(-n5c6ccccc6c6ccccc65)ccc43)c2)cc1.
What is the InChIKey of [2-(3-carbazol-9-ylcarbazol-9-yl)-4-triphenylsilylphenyl]-triphenylsilane?
The InChIKey is MDSRPZLKQQEJHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C66H48N2Si2/c1-7-25-50(26-8-1)69(51-27-9-2-10-28-51,52-29-11-3-12-30-52)56-44-46-66(70(53-31-13-4-14-32-53,54-33-15-5-16-34-54)55-35-17-6-18-36-55)65(48-56)68-63-42-24-21-39-59(63)60-47-49(43-45-64(60)68)67-61-40-22-19-37-57(61)58-38-20-23-41-62(58)67/h1-48H.
What are the key properties of [2-(3-carbazol-9-ylcarbazol-9-yl)-4-triphenylsilylphenyl]-triphenylsilane?
[2-(3-carbazol-9-ylcarbazol-9-yl)-4-triphenylsilylphenyl]-triphenylsilane has a molecular weight of 925.30 g/mol, XLogP of 10.64, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(3-carbazol-9-ylcarbazol-9-yl)-4-triphenylsilylphenyl]-triphenylsilane is sourced from PubChem (CID 177105255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).