carbazol-9-yl-(9H-fluoren-9-yl)-diphenylsilane

C37H27NSi — CID 71405582

IUPACcarbazol-9-yl-(9H-fluoren-9-yl)-diphenylsilane
SMILESc1ccc([Si](c2ccccc2)(C2c3ccccc3-c3ccccc32)n2c3ccccc3c3ccccc32)cc1
InChIInChI=1S/C37H27NSi/c1-3-15-27(16-4-1)39(28-17-5-2-6-18-28,37-33-23-9-7-19-29(33)30-20-8-10-24-34(30)37)38-35-25-13-11-21-31(35)32-22-12-14-26-36(32)38/h1-26,37H
InChIKeyCKLWYWQVKCBHPS-UHFFFAOYSA-N
MW513.72 g/mol
LogP7.75
Rot. Bonds4

About carbazol-9-yl-(9H-fluoren-9-yl)-diphenylsilane

carbazol-9-yl-(9H-fluoren-9-yl)-diphenylsilane (PubChem CID 71405582) has the molecular formula C37H27NSi and a molecular weight of 513.72 g/mol. Its IUPAC name is carbazol-9-yl-(9H-fluoren-9-yl)-diphenylsilane.

Molecular Properties

Compound Namecarbazol-9-yl-(9H-fluoren-9-yl)-diphenylsilane
PubChem CID71405582
Molecular FormulaC37H27NSi
Molecular Weight513.72 g/mol
Exact Mass513.19
IUPAC Namecarbazol-9-yl-(9H-fluoren-9-yl)-diphenylsilane
SMILESc1ccc([Si](c2ccccc2)(C2c3ccccc3-c3ccccc32)n2c3ccccc3c3ccccc32)cc1
InChIInChI=1S/C37H27NSi/c1-3-15-27(16-4-1)39(28-17-5-2-6-18-28,37-33-23-9-7-19-29(33)30-20-8-10-24-34(30)37)38-35-25-13-11-21-31(35)32-22-12-14-26-36(32)38/h1-26,37H
InChIKeyCKLWYWQVKCBHPS-UHFFFAOYSA-N
XLogP7.75
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms39
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500513.72
LogP ≤ 57.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of carbazol-9-yl-(9H-fluoren-9-yl)-diphenylsilane?
The IUPAC name of carbazol-9-yl-(9H-fluoren-9-yl)-diphenylsilane (CID 71405582) is carbazol-9-yl-(9H-fluoren-9-yl)-diphenylsilane.
What is the SMILES notation for carbazol-9-yl-(9H-fluoren-9-yl)-diphenylsilane?
The canonical SMILES for carbazol-9-yl-(9H-fluoren-9-yl)-diphenylsilane is c1ccc([Si](c2ccccc2)(C2c3ccccc3-c3ccccc32)n2c3ccccc3c3ccccc32)cc1.
What is the InChIKey of carbazol-9-yl-(9H-fluoren-9-yl)-diphenylsilane?
The InChIKey is CKLWYWQVKCBHPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C37H27NSi/c1-3-15-27(16-4-1)39(28-17-5-2-6-18-28,37-33-23-9-7-19-29(33)30-20-8-10-24-34(30)37)38-35-25-13-11-21-31(35)32-22-12-14-26-36(32)38/h1-26,37H.
What are the key properties of carbazol-9-yl-(9H-fluoren-9-yl)-diphenylsilane?
carbazol-9-yl-(9H-fluoren-9-yl)-diphenylsilane has a molecular weight of 513.72 g/mol, XLogP of 7.75, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for carbazol-9-yl-(9H-fluoren-9-yl)-diphenylsilane is sourced from PubChem (CID 71405582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).