difluoro-methyl-thiophen-2-ylsilane

C5H6F2SSi — CID 139680773

IUPACdifluoro-methyl-thiophen-2-ylsilane
SMILESC[Si](F)(F)c1cccs1
InChIInChI=1S/C5H6F2SSi/c1-9(6,7)5-3-2-4-8-5/h2-4H,1H3
InChIKeyJPUQQEMXHGVTOL-UHFFFAOYSA-N
MW164.25 g/mol
LogP1.97
Rot. Bonds1

About difluoro-methyl-thiophen-2-ylsilane

difluoro-methyl-thiophen-2-ylsilane (PubChem CID 139680773) has the molecular formula C5H6F2SSi and a molecular weight of 164.25 g/mol. Its IUPAC name is difluoro-methyl-thiophen-2-ylsilane.

Molecular Properties

Compound Namedifluoro-methyl-thiophen-2-ylsilane
PubChem CID139680773
Molecular FormulaC5H6F2SSi
Molecular Weight164.25 g/mol
Exact Mass163.99
IUPAC Namedifluoro-methyl-thiophen-2-ylsilane
SMILESC[Si](F)(F)c1cccs1
InChIInChI=1S/C5H6F2SSi/c1-9(6,7)5-3-2-4-8-5/h2-4H,1H3
InChIKeyJPUQQEMXHGVTOL-UHFFFAOYSA-N
XLogP1.97
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.25
LogP ≤ 51.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of difluoro-methyl-thiophen-2-ylsilane?
The IUPAC name of difluoro-methyl-thiophen-2-ylsilane (CID 139680773) is difluoro-methyl-thiophen-2-ylsilane.
What is the SMILES notation for difluoro-methyl-thiophen-2-ylsilane?
The canonical SMILES for difluoro-methyl-thiophen-2-ylsilane is C[Si](F)(F)c1cccs1.
What is the InChIKey of difluoro-methyl-thiophen-2-ylsilane?
The InChIKey is JPUQQEMXHGVTOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6F2SSi/c1-9(6,7)5-3-2-4-8-5/h2-4H,1H3.
What are the key properties of difluoro-methyl-thiophen-2-ylsilane?
difluoro-methyl-thiophen-2-ylsilane has a molecular weight of 164.25 g/mol, XLogP of 1.97, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for difluoro-methyl-thiophen-2-ylsilane is sourced from PubChem (CID 139680773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).