trifluoro-[(E)-2-methylbut-2-enyl]silane

C5H9F3Si — CID 5362698

IUPACtrifluoro-[(E)-2-methylbut-2-enyl]silane
SMILESC/C=C(\C)C[Si](F)(F)F
InChIInChI=1S/C5H9F3Si/c1-3-5(2)4-9(6,7)8/h3H,4H2,1-2H3/b5-3+
InChIKeyXXPNUJCCKBFOJE-HWKANZROSA-N
MW154.21 g/mol
LogP2.80
Rot. Bonds2

About trifluoro-[(E)-2-methylbut-2-enyl]silane

trifluoro-[(E)-2-methylbut-2-enyl]silane (PubChem CID 5362698) has the molecular formula C5H9F3Si and a molecular weight of 154.21 g/mol. Its IUPAC name is trifluoro-[(E)-2-methylbut-2-enyl]silane.

Molecular Properties

Compound Nametrifluoro-[(E)-2-methylbut-2-enyl]silane
PubChem CID5362698
Molecular FormulaC5H9F3Si
Molecular Weight154.21 g/mol
Exact Mass154.04
IUPAC Nametrifluoro-[(E)-2-methylbut-2-enyl]silane
SMILESC/C=C(\C)C[Si](F)(F)F
InChIInChI=1S/C5H9F3Si/c1-3-5(2)4-9(6,7)8/h3H,4H2,1-2H3/b5-3+
InChIKeyXXPNUJCCKBFOJE-HWKANZROSA-N
XLogP2.80
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.21
LogP ≤ 52.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze trifluoro-[(E)-2-methylbut-2-enyl]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 trifluoro-[(E)-2-methylbut-2-enyl]silane?
The IUPAC name of trifluoro-[(E)-2-methylbut-2-enyl]silane (CID 5362698) is trifluoro-[(E)-2-methylbut-2-enyl]silane.
What is the SMILES notation for trifluoro-[(E)-2-methylbut-2-enyl]silane?
The canonical SMILES for trifluoro-[(E)-2-methylbut-2-enyl]silane is C/C=C(\C)C[Si](F)(F)F.
What is the InChIKey of trifluoro-[(E)-2-methylbut-2-enyl]silane?
The InChIKey is XXPNUJCCKBFOJE-HWKANZROSA-N. The full InChI is InChI=1S/C5H9F3Si/c1-3-5(2)4-9(6,7)8/h3H,4H2,1-2H3/b5-3+.
What are the key properties of trifluoro-[(E)-2-methylbut-2-enyl]silane?
trifluoro-[(E)-2-methylbut-2-enyl]silane has a molecular weight of 154.21 g/mol, XLogP of 2.80, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trifluoro-[(E)-2-methylbut-2-enyl]silane is sourced from PubChem (CID 5362698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).