[9-(4-methylphenyl)carbazol-3-yl]-triphenylsilane

C37H29NSi — CID 168811108

IUPAC[9-(4-methylphenyl)carbazol-3-yl]-triphenylsilane
SMILESCc1ccc(-n2c3ccccc3c3cc([Si](c4ccccc4)(c4ccccc4)c4ccccc4)ccc32)cc1
InChIInChI=1S/C37H29NSi/c1-28-21-23-29(24-22-28)38-36-20-12-11-19-34(36)35-27-33(25-26-37(35)38)39(30-13-5-2-6-14-30,31-15-7-3-8-16-31)32-17-9-4-10-18-32/h2-27H,1H3
InChIKeyJHAMQORVJVJFMP-UHFFFAOYSA-N
MW515.73 g/mol
LogP6.47
Rot. Bonds5

About [9-(4-methylphenyl)carbazol-3-yl]-triphenylsilane

[9-(4-methylphenyl)carbazol-3-yl]-triphenylsilane (PubChem CID 168811108) has the molecular formula C37H29NSi and a molecular weight of 515.73 g/mol. Its IUPAC name is [9-(4-methylphenyl)carbazol-3-yl]-triphenylsilane.

Molecular Properties

Compound Name[9-(4-methylphenyl)carbazol-3-yl]-triphenylsilane
PubChem CID168811108
Molecular FormulaC37H29NSi
Molecular Weight515.73 g/mol
Exact Mass515.21
IUPAC Name[9-(4-methylphenyl)carbazol-3-yl]-triphenylsilane
SMILESCc1ccc(-n2c3ccccc3c3cc([Si](c4ccccc4)(c4ccccc4)c4ccccc4)ccc32)cc1
InChIInChI=1S/C37H29NSi/c1-28-21-23-29(24-22-28)38-36-20-12-11-19-34(36)35-27-33(25-26-37(35)38)39(30-13-5-2-6-14-30,31-15-7-3-8-16-31)32-17-9-4-10-18-32/h2-27H,1H3
InChIKeyJHAMQORVJVJFMP-UHFFFAOYSA-N
XLogP6.47
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms39
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500515.73
LogP ≤ 56.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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

(4-methylphenyl)-diphenyl-(9-phenylcarbazol-3-yl)silane
CID 158052706
diphenyl-(9-phenylcarbazol-3-yl)-[9-(9-phenylcarbazol-3-yl)carbazol-3-yl]silane
CID 89393751
[9-[4-[(E)-2-[4-(3-methylcarbazol-9-yl)phenyl]ethenyl]phenyl]carbazol-3-yl]-triphenylsilane
CID 159127596
[4-[3,6-di(carbazol-9-yl)carbazol-9-yl]phenyl]-triphenylsilane
CID 159773868
[9-[7-carbazol-9-yl-9-(4-phenylphenyl)carbazol-2-yl]carbazol-3-yl]-triphenylsilane
CID 170515024
bis(4-carbazol-9-ylphenyl)-diphenylsilane
CID 139043550
triphenyl-[4-[3-[4-(9-phenylcarbazol-3-yl)phenyl]carbazol-9-yl]phenyl]silane
CID 140782739
triphenyl-[9-phenyl-6-[9-[4-(3-phenylphenyl)phenyl]carbazol-3-yl]carbazol-3-yl]silane
CID 140790437
[9-[2-[2-[3-(3-methylcarbazol-9-yl)carbazol-9-yl]phenyl]phenyl]carbazol-3-yl]-triphenylsilane
CID 174139185
[6-(4-carbazol-9-ylphenyl)-9-phenylcarbazol-2-yl]-triphenylsilane
CID 140778740
triphenyl-[6-(2-phenylcarbazol-9-yl)-9-(9-phenylcarbazol-3-yl)carbazol-3-yl]silane
CID 170516502
[7-carbazol-9-yl-9-(9-phenylcarbazol-3-yl)carbazol-2-yl]-triphenylsilane
CID 170516315

Frequently Asked Questions

What is the IUPAC name of [9-(4-methylphenyl)carbazol-3-yl]-triphenylsilane?
The IUPAC name of [9-(4-methylphenyl)carbazol-3-yl]-triphenylsilane (CID 168811108) is [9-(4-methylphenyl)carbazol-3-yl]-triphenylsilane.
What is the SMILES notation for [9-(4-methylphenyl)carbazol-3-yl]-triphenylsilane?
The canonical SMILES for [9-(4-methylphenyl)carbazol-3-yl]-triphenylsilane is Cc1ccc(-n2c3ccccc3c3cc([Si](c4ccccc4)(c4ccccc4)c4ccccc4)ccc32)cc1.
What is the InChIKey of [9-(4-methylphenyl)carbazol-3-yl]-triphenylsilane?
The InChIKey is JHAMQORVJVJFMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C37H29NSi/c1-28-21-23-29(24-22-28)38-36-20-12-11-19-34(36)35-27-33(25-26-37(35)38)39(30-13-5-2-6-14-30,31-15-7-3-8-16-31)32-17-9-4-10-18-32/h2-27H,1H3.
What are the key properties of [9-(4-methylphenyl)carbazol-3-yl]-triphenylsilane?
[9-(4-methylphenyl)carbazol-3-yl]-triphenylsilane has a molecular weight of 515.73 g/mol, XLogP of 6.47, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [9-(4-methylphenyl)carbazol-3-yl]-triphenylsilane is sourced from PubChem (CID 168811108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).