trimethyl-(5-phenylsulfanylcyclopenten-1-yl)oxysilane

C14H20OSSi — CID 12851426

IUPACtrimethyl-(5-phenylsulfanylcyclopenten-1-yl)oxysilane
SMILESC[Si](C)(C)OC1=CCCC1Sc1ccccc1
InChIInChI=1S/C14H20OSSi/c1-17(2,3)15-13-10-7-11-14(13)16-12-8-5-4-6-9-12/h4-6,8-10,14H,7,11H2,1-3H3
InChIKeyWMJSXJGWOAVATO-UHFFFAOYSA-N
MW264.47 g/mol
LogP4.68
Rot. Bonds4

About trimethyl-(5-phenylsulfanylcyclopenten-1-yl)oxysilane

trimethyl-(5-phenylsulfanylcyclopenten-1-yl)oxysilane (PubChem CID 12851426) has the molecular formula C14H20OSSi and a molecular weight of 264.47 g/mol. Its IUPAC name is trimethyl-(5-phenylsulfanylcyclopenten-1-yl)oxysilane.

Molecular Properties

Compound Nametrimethyl-(5-phenylsulfanylcyclopenten-1-yl)oxysilane
PubChem CID12851426
Molecular FormulaC14H20OSSi
Molecular Weight264.47 g/mol
Exact Mass264.10
IUPAC Nametrimethyl-(5-phenylsulfanylcyclopenten-1-yl)oxysilane
SMILESC[Si](C)(C)OC1=CCCC1Sc1ccccc1
InChIInChI=1S/C14H20OSSi/c1-17(2,3)15-13-10-7-11-14(13)16-12-8-5-4-6-9-12/h4-6,8-10,14H,7,11H2,1-3H3
InChIKeyWMJSXJGWOAVATO-UHFFFAOYSA-N
XLogP4.68
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.47
LogP ≤ 54.68
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 trimethyl-(5-phenylsulfanylcyclopenten-1-yl)oxysilane?
The IUPAC name of trimethyl-(5-phenylsulfanylcyclopenten-1-yl)oxysilane (CID 12851426) is trimethyl-(5-phenylsulfanylcyclopenten-1-yl)oxysilane.
What is the SMILES notation for trimethyl-(5-phenylsulfanylcyclopenten-1-yl)oxysilane?
The canonical SMILES for trimethyl-(5-phenylsulfanylcyclopenten-1-yl)oxysilane is C[Si](C)(C)OC1=CCCC1Sc1ccccc1.
What is the InChIKey of trimethyl-(5-phenylsulfanylcyclopenten-1-yl)oxysilane?
The InChIKey is WMJSXJGWOAVATO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20OSSi/c1-17(2,3)15-13-10-7-11-14(13)16-12-8-5-4-6-9-12/h4-6,8-10,14H,7,11H2,1-3H3.
What are the key properties of trimethyl-(5-phenylsulfanylcyclopenten-1-yl)oxysilane?
trimethyl-(5-phenylsulfanylcyclopenten-1-yl)oxysilane has a molecular weight of 264.47 g/mol, XLogP of 4.68, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-(5-phenylsulfanylcyclopenten-1-yl)oxysilane is sourced from PubChem (CID 12851426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).