triethyl-(2,2,3,3-tetrafluoro-1-phenylpent-4-enoxy)silane

C17H24F4OSi — CID 134836305

IUPACtriethyl-(2,2,3,3-tetrafluoro-1-phenylpent-4-enoxy)silane
SMILESC=CC(F)(F)C(F)(F)C(O[Si](CC)(CC)CC)c1ccccc1
InChIInChI=1S/C17H24F4OSi/c1-5-16(18,19)17(20,21)15(14-12-10-9-11-13-14)22-23(6-2,7-3)8-4/h5,9-13,15H,1,6-8H2,2-4H3
InChIKeyJQBNAGWSWTZAOW-UHFFFAOYSA-N
MW348.46 g/mol
LogP6.21
Rot. Bonds9

About triethyl-(2,2,3,3-tetrafluoro-1-phenylpent-4-enoxy)silane

triethyl-(2,2,3,3-tetrafluoro-1-phenylpent-4-enoxy)silane (PubChem CID 134836305) has the molecular formula C17H24F4OSi and a molecular weight of 348.46 g/mol. Its IUPAC name is triethyl-(2,2,3,3-tetrafluoro-1-phenylpent-4-enoxy)silane.

Molecular Properties

Compound Nametriethyl-(2,2,3,3-tetrafluoro-1-phenylpent-4-enoxy)silane
PubChem CID134836305
Molecular FormulaC17H24F4OSi
Molecular Weight348.46 g/mol
Exact Mass348.15
IUPAC Nametriethyl-(2,2,3,3-tetrafluoro-1-phenylpent-4-enoxy)silane
SMILESC=CC(F)(F)C(F)(F)C(O[Si](CC)(CC)CC)c1ccccc1
InChIInChI=1S/C17H24F4OSi/c1-5-16(18,19)17(20,21)15(14-12-10-9-11-13-14)22-23(6-2,7-3)8-4/h5,9-13,15H,1,6-8H2,2-4H3
InChIKeyJQBNAGWSWTZAOW-UHFFFAOYSA-N
XLogP6.21
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500348.46
LogP ≤ 56.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of triethyl-(2,2,3,3-tetrafluoro-1-phenylpent-4-enoxy)silane?
The IUPAC name of triethyl-(2,2,3,3-tetrafluoro-1-phenylpent-4-enoxy)silane (CID 134836305) is triethyl-(2,2,3,3-tetrafluoro-1-phenylpent-4-enoxy)silane.
What is the SMILES notation for triethyl-(2,2,3,3-tetrafluoro-1-phenylpent-4-enoxy)silane?
The canonical SMILES for triethyl-(2,2,3,3-tetrafluoro-1-phenylpent-4-enoxy)silane is C=CC(F)(F)C(F)(F)C(O[Si](CC)(CC)CC)c1ccccc1.
What is the InChIKey of triethyl-(2,2,3,3-tetrafluoro-1-phenylpent-4-enoxy)silane?
The InChIKey is JQBNAGWSWTZAOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24F4OSi/c1-5-16(18,19)17(20,21)15(14-12-10-9-11-13-14)22-23(6-2,7-3)8-4/h5,9-13,15H,1,6-8H2,2-4H3.
What are the key properties of triethyl-(2,2,3,3-tetrafluoro-1-phenylpent-4-enoxy)silane?
triethyl-(2,2,3,3-tetrafluoro-1-phenylpent-4-enoxy)silane has a molecular weight of 348.46 g/mol, XLogP of 6.21, 9 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for triethyl-(2,2,3,3-tetrafluoro-1-phenylpent-4-enoxy)silane is sourced from PubChem (CID 134836305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).