ethenyl-diethoxy-(3,3,3-trifluoropropyl)silane

C9H17F3O2Si — CID 87528827

IUPACethenyl-diethoxy-(3,3,3-trifluoropropyl)silane
SMILESC=C[Si](CCC(F)(F)F)(OCC)OCC
InChIInChI=1S/C9H17F3O2Si/c1-4-13-15(6-3,14-5-2)8-7-9(10,11)12/h6H,3-5,7-8H2,1-2H3
InChIKeyOYMVGHHRCJOTHG-UHFFFAOYSA-N
MW242.31 g/mol
LogP3.18
Rot. Bonds7

About ethenyl-diethoxy-(3,3,3-trifluoropropyl)silane

ethenyl-diethoxy-(3,3,3-trifluoropropyl)silane (PubChem CID 87528827) has the molecular formula C9H17F3O2Si and a molecular weight of 242.31 g/mol. Its IUPAC name is ethenyl-diethoxy-(3,3,3-trifluoropropyl)silane.

Molecular Properties

Compound Nameethenyl-diethoxy-(3,3,3-trifluoropropyl)silane
PubChem CID87528827
Molecular FormulaC9H17F3O2Si
Molecular Weight242.31 g/mol
Exact Mass242.09
IUPAC Nameethenyl-diethoxy-(3,3,3-trifluoropropyl)silane
SMILESC=C[Si](CCC(F)(F)F)(OCC)OCC
InChIInChI=1S/C9H17F3O2Si/c1-4-13-15(6-3,14-5-2)8-7-9(10,11)12/h6H,3-5,7-8H2,1-2H3
InChIKeyOYMVGHHRCJOTHG-UHFFFAOYSA-N
XLogP3.18
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.31
LogP ≤ 53.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 ethenyl-diethoxy-(3,3,3-trifluoropropyl)silane?
The IUPAC name of ethenyl-diethoxy-(3,3,3-trifluoropropyl)silane (CID 87528827) is ethenyl-diethoxy-(3,3,3-trifluoropropyl)silane.
What is the SMILES notation for ethenyl-diethoxy-(3,3,3-trifluoropropyl)silane?
The canonical SMILES for ethenyl-diethoxy-(3,3,3-trifluoropropyl)silane is C=C[Si](CCC(F)(F)F)(OCC)OCC.
What is the InChIKey of ethenyl-diethoxy-(3,3,3-trifluoropropyl)silane?
The InChIKey is OYMVGHHRCJOTHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17F3O2Si/c1-4-13-15(6-3,14-5-2)8-7-9(10,11)12/h6H,3-5,7-8H2,1-2H3.
What are the key properties of ethenyl-diethoxy-(3,3,3-trifluoropropyl)silane?
ethenyl-diethoxy-(3,3,3-trifluoropropyl)silane has a molecular weight of 242.31 g/mol, XLogP of 3.18, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethenyl-diethoxy-(3,3,3-trifluoropropyl)silane is sourced from PubChem (CID 87528827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).