diethoxy(4,5,5-trifluoropent-1-en-2-yl)silane

C9H17F3O2Si — CID 173100229

IUPACdiethoxy(4,5,5-trifluoropent-1-en-2-yl)silane
SMILESC=C(CC(F)C(F)F)[SiH](OCC)OCC
InChIInChI=1S/C9H17F3O2Si/c1-4-13-15(14-5-2)7(3)6-8(10)9(11)12/h8-9,15H,3-6H2,1-2H3
InChIKeyXBRSLDXUQPVCLX-UHFFFAOYSA-N
MW242.31 g/mol
LogP2.37
Rot. Bonds8

About diethoxy(4,5,5-trifluoropent-1-en-2-yl)silane

diethoxy(4,5,5-trifluoropent-1-en-2-yl)silane (PubChem CID 173100229) has the molecular formula C9H17F3O2Si and a molecular weight of 242.31 g/mol. Its IUPAC name is diethoxy(4,5,5-trifluoropent-1-en-2-yl)silane.

Molecular Properties

Compound Namediethoxy(4,5,5-trifluoropent-1-en-2-yl)silane
PubChem CID173100229
Molecular FormulaC9H17F3O2Si
Molecular Weight242.31 g/mol
Exact Mass242.09
IUPAC Namediethoxy(4,5,5-trifluoropent-1-en-2-yl)silane
SMILESC=C(CC(F)C(F)F)[SiH](OCC)OCC
InChIInChI=1S/C9H17F3O2Si/c1-4-13-15(14-5-2)7(3)6-8(10)9(11)12/h8-9,15H,3-6H2,1-2H3
InChIKeyXBRSLDXUQPVCLX-UHFFFAOYSA-N
XLogP2.37
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.31
LogP ≤ 52.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze diethoxy(4,5,5-trifluoropent-1-en-2-yl)silane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of diethoxy(4,5,5-trifluoropent-1-en-2-yl)silane?
The IUPAC name of diethoxy(4,5,5-trifluoropent-1-en-2-yl)silane (CID 173100229) is diethoxy(4,5,5-trifluoropent-1-en-2-yl)silane.
What is the SMILES notation for diethoxy(4,5,5-trifluoropent-1-en-2-yl)silane?
The canonical SMILES for diethoxy(4,5,5-trifluoropent-1-en-2-yl)silane is C=C(CC(F)C(F)F)[SiH](OCC)OCC.
What is the InChIKey of diethoxy(4,5,5-trifluoropent-1-en-2-yl)silane?
The InChIKey is XBRSLDXUQPVCLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17F3O2Si/c1-4-13-15(14-5-2)7(3)6-8(10)9(11)12/h8-9,15H,3-6H2,1-2H3.
What are the key properties of diethoxy(4,5,5-trifluoropent-1-en-2-yl)silane?
diethoxy(4,5,5-trifluoropent-1-en-2-yl)silane has a molecular weight of 242.31 g/mol, XLogP of 2.37, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for diethoxy(4,5,5-trifluoropent-1-en-2-yl)silane is sourced from PubChem (CID 173100229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).