butoxy-(2-fluoroethoxy)-diphenylsilane

C18H23FO2Si — CID 91717515

IUPACbutoxy-(2-fluoroethoxy)-diphenylsilane
SMILESCCCCO[Si](OCCF)(c1ccccc1)c1ccccc1
InChIInChI=1S/C18H23FO2Si/c1-2-3-15-20-22(21-16-14-19,17-10-6-4-7-11-17)18-12-8-5-9-13-18/h4-13H,2-3,14-16H2,1H3
InChIKeyMKOYOUNDLJRRJV-UHFFFAOYSA-N
MW318.46 g/mol
LogP3.05
Rot. Bonds9

About butoxy-(2-fluoroethoxy)-diphenylsilane

butoxy-(2-fluoroethoxy)-diphenylsilane (PubChem CID 91717515) has the molecular formula C18H23FO2Si and a molecular weight of 318.46 g/mol. Its IUPAC name is butoxy-(2-fluoroethoxy)-diphenylsilane.

Molecular Properties

Compound Namebutoxy-(2-fluoroethoxy)-diphenylsilane
PubChem CID91717515
Molecular FormulaC18H23FO2Si
Molecular Weight318.46 g/mol
Exact Mass318.15
IUPAC Namebutoxy-(2-fluoroethoxy)-diphenylsilane
SMILESCCCCO[Si](OCCF)(c1ccccc1)c1ccccc1
InChIInChI=1S/C18H23FO2Si/c1-2-3-15-20-22(21-16-14-19,17-10-6-4-7-11-17)18-12-8-5-9-13-18/h4-13H,2-3,14-16H2,1H3
InChIKeyMKOYOUNDLJRRJV-UHFFFAOYSA-N
XLogP3.05
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.46
LogP ≤ 53.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of butoxy-(2-fluoroethoxy)-diphenylsilane?
The IUPAC name of butoxy-(2-fluoroethoxy)-diphenylsilane (CID 91717515) is butoxy-(2-fluoroethoxy)-diphenylsilane.
What is the SMILES notation for butoxy-(2-fluoroethoxy)-diphenylsilane?
The canonical SMILES for butoxy-(2-fluoroethoxy)-diphenylsilane is CCCCO[Si](OCCF)(c1ccccc1)c1ccccc1.
What is the InChIKey of butoxy-(2-fluoroethoxy)-diphenylsilane?
The InChIKey is MKOYOUNDLJRRJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23FO2Si/c1-2-3-15-20-22(21-16-14-19,17-10-6-4-7-11-17)18-12-8-5-9-13-18/h4-13H,2-3,14-16H2,1H3.
What are the key properties of butoxy-(2-fluoroethoxy)-diphenylsilane?
butoxy-(2-fluoroethoxy)-diphenylsilane has a molecular weight of 318.46 g/mol, XLogP of 3.05, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for butoxy-(2-fluoroethoxy)-diphenylsilane is sourced from PubChem (CID 91717515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).