2,2,6-triethyl-6-(1-fluoropentyl)oxasilinane

C15H31FOSi — CID 175045684

IUPAC2,2,6-triethyl-6-(1-fluoropentyl)oxasilinane
SMILESCCCCC(F)C1(CC)CCC[Si](CC)(CC)O1
InChIInChI=1S/C15H31FOSi/c1-5-9-11-14(16)15(6-2)12-10-13-18(7-3,8-4)17-15/h14H,5-13H2,1-4H3
InChIKeyPZZJGFOGWKATBE-UHFFFAOYSA-N
MW274.50 g/mol
LogP5.46
Rot. Bonds7

About 2,2,6-triethyl-6-(1-fluoropentyl)oxasilinane

2,2,6-triethyl-6-(1-fluoropentyl)oxasilinane (PubChem CID 175045684) has the molecular formula C15H31FOSi and a molecular weight of 274.50 g/mol. Its IUPAC name is 2,2,6-triethyl-6-(1-fluoropentyl)oxasilinane.

Molecular Properties

Compound Name2,2,6-triethyl-6-(1-fluoropentyl)oxasilinane
PubChem CID175045684
Molecular FormulaC15H31FOSi
Molecular Weight274.50 g/mol
Exact Mass274.21
IUPAC Name2,2,6-triethyl-6-(1-fluoropentyl)oxasilinane
SMILESCCCCC(F)C1(CC)CCC[Si](CC)(CC)O1
InChIInChI=1S/C15H31FOSi/c1-5-9-11-14(16)15(6-2)12-10-13-18(7-3,8-4)17-15/h14H,5-13H2,1-4H3
InChIKeyPZZJGFOGWKATBE-UHFFFAOYSA-N
XLogP5.46
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500274.50
LogP ≤ 55.46
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 2,2,6-triethyl-6-(1-fluoropentyl)oxasilinane?
The IUPAC name of 2,2,6-triethyl-6-(1-fluoropentyl)oxasilinane (CID 175045684) is 2,2,6-triethyl-6-(1-fluoropentyl)oxasilinane.
What is the SMILES notation for 2,2,6-triethyl-6-(1-fluoropentyl)oxasilinane?
The canonical SMILES for 2,2,6-triethyl-6-(1-fluoropentyl)oxasilinane is CCCCC(F)C1(CC)CCC[Si](CC)(CC)O1.
What is the InChIKey of 2,2,6-triethyl-6-(1-fluoropentyl)oxasilinane?
The InChIKey is PZZJGFOGWKATBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31FOSi/c1-5-9-11-14(16)15(6-2)12-10-13-18(7-3,8-4)17-15/h14H,5-13H2,1-4H3.
What are the key properties of 2,2,6-triethyl-6-(1-fluoropentyl)oxasilinane?
2,2,6-triethyl-6-(1-fluoropentyl)oxasilinane has a molecular weight of 274.50 g/mol, XLogP of 5.46, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,6-triethyl-6-(1-fluoropentyl)oxasilinane is sourced from PubChem (CID 175045684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).