(2,2-difluoro-1-triphenylsilylethenoxy)-triphenylsilane

C38H30F2OSi2 — CID 11284824

IUPAC(2,2-difluoro-1-triphenylsilylethenoxy)-triphenylsilane
SMILESFC(F)=C(O[Si](c1ccccc1)(c1ccccc1)c1ccccc1)[Si](c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C38H30F2OSi2/c39-37(40)38(42(31-19-7-1-8-20-31,32-21-9-2-10-22-32)33-23-11-3-12-24-33)41-43(34-25-13-4-14-26-34,35-27-15-5-16-28-35)36-29-17-6-18-30-36/h1-30H
InChIKeyAUBZPJCGQDYSHB-UHFFFAOYSA-N
MW596.83 g/mol
LogP5.49
Rot. Bonds9

About (2,2-difluoro-1-triphenylsilylethenoxy)-triphenylsilane

(2,2-difluoro-1-triphenylsilylethenoxy)-triphenylsilane (PubChem CID 11284824) has the molecular formula C38H30F2OSi2 and a molecular weight of 596.83 g/mol. Its IUPAC name is (2,2-difluoro-1-triphenylsilylethenoxy)-triphenylsilane.

Molecular Properties

Compound Name(2,2-difluoro-1-triphenylsilylethenoxy)-triphenylsilane
PubChem CID11284824
Molecular FormulaC38H30F2OSi2
Molecular Weight596.83 g/mol
Exact Mass596.18
IUPAC Name(2,2-difluoro-1-triphenylsilylethenoxy)-triphenylsilane
SMILESFC(F)=C(O[Si](c1ccccc1)(c1ccccc1)c1ccccc1)[Si](c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C38H30F2OSi2/c39-37(40)38(42(31-19-7-1-8-20-31,32-21-9-2-10-22-32)33-23-11-3-12-24-33)41-43(34-25-13-4-14-26-34,35-27-15-5-16-28-35)36-29-17-6-18-30-36/h1-30H
InChIKeyAUBZPJCGQDYSHB-UHFFFAOYSA-N
XLogP5.49
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms43
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500596.83
LogP ≤ 55.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'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 (2,2-difluoro-1-triphenylsilylethenoxy)-triphenylsilane?
The IUPAC name of (2,2-difluoro-1-triphenylsilylethenoxy)-triphenylsilane (CID 11284824) is (2,2-difluoro-1-triphenylsilylethenoxy)-triphenylsilane.
What is the SMILES notation for (2,2-difluoro-1-triphenylsilylethenoxy)-triphenylsilane?
The canonical SMILES for (2,2-difluoro-1-triphenylsilylethenoxy)-triphenylsilane is FC(F)=C(O[Si](c1ccccc1)(c1ccccc1)c1ccccc1)[Si](c1ccccc1)(c1ccccc1)c1ccccc1.
What is the InChIKey of (2,2-difluoro-1-triphenylsilylethenoxy)-triphenylsilane?
The InChIKey is AUBZPJCGQDYSHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C38H30F2OSi2/c39-37(40)38(42(31-19-7-1-8-20-31,32-21-9-2-10-22-32)33-23-11-3-12-24-33)41-43(34-25-13-4-14-26-34,35-27-15-5-16-28-35)36-29-17-6-18-30-36/h1-30H.
What are the key properties of (2,2-difluoro-1-triphenylsilylethenoxy)-triphenylsilane?
(2,2-difluoro-1-triphenylsilylethenoxy)-triphenylsilane has a molecular weight of 596.83 g/mol, XLogP of 5.49, 9 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2,2-difluoro-1-triphenylsilylethenoxy)-triphenylsilane is sourced from PubChem (CID 11284824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).