[2-fluoro-9-(triphenylsilyloxymethyl)fluoren-9-yl]methoxy-triphenylsilane

C51H41FO2Si2 — CID 22639130

IUPAC[2-fluoro-9-(triphenylsilyloxymethyl)fluoren-9-yl]methoxy-triphenylsilane
SMILESFc1ccc2c(c1)C(CO[Si](c1ccccc1)(c1ccccc1)c1ccccc1)(CO[Si](c1ccccc1)(c1ccccc1)c1ccccc1)c1ccccc1-2
InChIInChI=1S/C51H41FO2Si2/c52-40-35-36-48-47-33-19-20-34-49(47)51(50(48)37-40,38-53-55(41-21-7-1-8-22-41,42-23-9-2-10-24-42)43-25-11-3-12-26-43)39-54-56(44-27-13-4-14-28-44,45-29-15-5-16-30-45)46-31-17-6-18-32-46/h1-37H,38-39H2
InChIKeyAHSXOJUVHMGQRO-UHFFFAOYSA-N
MW761.06 g/mol
LogP7.46
Rot. Bonds12

About [2-fluoro-9-(triphenylsilyloxymethyl)fluoren-9-yl]methoxy-triphenylsilane

[2-fluoro-9-(triphenylsilyloxymethyl)fluoren-9-yl]methoxy-triphenylsilane (PubChem CID 22639130) has the molecular formula C51H41FO2Si2 and a molecular weight of 761.06 g/mol. Its IUPAC name is [2-fluoro-9-(triphenylsilyloxymethyl)fluoren-9-yl]methoxy-triphenylsilane.

Molecular Properties

Compound Name[2-fluoro-9-(triphenylsilyloxymethyl)fluoren-9-yl]methoxy-triphenylsilane
PubChem CID22639130
Molecular FormulaC51H41FO2Si2
Molecular Weight761.06 g/mol
Exact Mass760.26
IUPAC Name[2-fluoro-9-(triphenylsilyloxymethyl)fluoren-9-yl]methoxy-triphenylsilane
SMILESFc1ccc2c(c1)C(CO[Si](c1ccccc1)(c1ccccc1)c1ccccc1)(CO[Si](c1ccccc1)(c1ccccc1)c1ccccc1)c1ccccc1-2
InChIInChI=1S/C51H41FO2Si2/c52-40-35-36-48-47-33-19-20-34-49(47)51(50(48)37-40,38-53-55(41-21-7-1-8-22-41,42-23-9-2-10-24-42)43-25-11-3-12-26-43)39-54-56(44-27-13-4-14-28-44,45-29-15-5-16-30-45)46-31-17-6-18-32-46/h1-37H,38-39H2
InChIKeyAHSXOJUVHMGQRO-UHFFFAOYSA-N
XLogP7.46
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds12
Heavy Atoms56
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500761.06
LogP ≤ 57.46
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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Frequently Asked Questions

What is the IUPAC name of [2-fluoro-9-(triphenylsilyloxymethyl)fluoren-9-yl]methoxy-triphenylsilane?
The IUPAC name of [2-fluoro-9-(triphenylsilyloxymethyl)fluoren-9-yl]methoxy-triphenylsilane (CID 22639130) is [2-fluoro-9-(triphenylsilyloxymethyl)fluoren-9-yl]methoxy-triphenylsilane.
What is the SMILES notation for [2-fluoro-9-(triphenylsilyloxymethyl)fluoren-9-yl]methoxy-triphenylsilane?
The canonical SMILES for [2-fluoro-9-(triphenylsilyloxymethyl)fluoren-9-yl]methoxy-triphenylsilane is Fc1ccc2c(c1)C(CO[Si](c1ccccc1)(c1ccccc1)c1ccccc1)(CO[Si](c1ccccc1)(c1ccccc1)c1ccccc1)c1ccccc1-2.
What is the InChIKey of [2-fluoro-9-(triphenylsilyloxymethyl)fluoren-9-yl]methoxy-triphenylsilane?
The InChIKey is AHSXOJUVHMGQRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C51H41FO2Si2/c52-40-35-36-48-47-33-19-20-34-49(47)51(50(48)37-40,38-53-55(41-21-7-1-8-22-41,42-23-9-2-10-24-42)43-25-11-3-12-26-43)39-54-56(44-27-13-4-14-28-44,45-29-15-5-16-30-45)46-31-17-6-18-32-46/h1-37H,38-39H2.
What are the key properties of [2-fluoro-9-(triphenylsilyloxymethyl)fluoren-9-yl]methoxy-triphenylsilane?
[2-fluoro-9-(triphenylsilyloxymethyl)fluoren-9-yl]methoxy-triphenylsilane has a molecular weight of 761.06 g/mol, XLogP of 7.46, 12 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-fluoro-9-(triphenylsilyloxymethyl)fluoren-9-yl]methoxy-triphenylsilane is sourced from PubChem (CID 22639130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).