trimethyl-(3-thiophen-3-ylcyclohexen-1-yl)oxysilane

C13H20OSSi — CID 10562803

IUPACtrimethyl-(3-thiophen-3-ylcyclohexen-1-yl)oxysilane
SMILESC[Si](C)(C)OC1=CC(c2ccsc2)CCC1
InChIInChI=1S/C13H20OSSi/c1-16(2,3)14-13-6-4-5-11(9-13)12-7-8-15-10-12/h7-11H,4-6H2,1-3H3
InChIKeyAQLZFGBDGLISIP-UHFFFAOYSA-N
MW252.45 g/mol
LogP4.75
Rot. Bonds3

About trimethyl-(3-thiophen-3-ylcyclohexen-1-yl)oxysilane

trimethyl-(3-thiophen-3-ylcyclohexen-1-yl)oxysilane (PubChem CID 10562803) has the molecular formula C13H20OSSi and a molecular weight of 252.45 g/mol. Its IUPAC name is trimethyl-(3-thiophen-3-ylcyclohexen-1-yl)oxysilane.

Molecular Properties

Compound Nametrimethyl-(3-thiophen-3-ylcyclohexen-1-yl)oxysilane
PubChem CID10562803
Molecular FormulaC13H20OSSi
Molecular Weight252.45 g/mol
Exact Mass252.10
IUPAC Nametrimethyl-(3-thiophen-3-ylcyclohexen-1-yl)oxysilane
SMILESC[Si](C)(C)OC1=CC(c2ccsc2)CCC1
InChIInChI=1S/C13H20OSSi/c1-16(2,3)14-13-6-4-5-11(9-13)12-7-8-15-10-12/h7-11H,4-6H2,1-3H3
InChIKeyAQLZFGBDGLISIP-UHFFFAOYSA-N
XLogP4.75
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.45
LogP ≤ 54.75
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-(3-thiophen-3-ylcyclohexen-1-yl)oxysilane?
The IUPAC name of trimethyl-(3-thiophen-3-ylcyclohexen-1-yl)oxysilane (CID 10562803) is trimethyl-(3-thiophen-3-ylcyclohexen-1-yl)oxysilane.
What is the SMILES notation for trimethyl-(3-thiophen-3-ylcyclohexen-1-yl)oxysilane?
The canonical SMILES for trimethyl-(3-thiophen-3-ylcyclohexen-1-yl)oxysilane is C[Si](C)(C)OC1=CC(c2ccsc2)CCC1.
What is the InChIKey of trimethyl-(3-thiophen-3-ylcyclohexen-1-yl)oxysilane?
The InChIKey is AQLZFGBDGLISIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20OSSi/c1-16(2,3)14-13-6-4-5-11(9-13)12-7-8-15-10-12/h7-11H,4-6H2,1-3H3.
What are the key properties of trimethyl-(3-thiophen-3-ylcyclohexen-1-yl)oxysilane?
trimethyl-(3-thiophen-3-ylcyclohexen-1-yl)oxysilane has a molecular weight of 252.45 g/mol, XLogP of 4.75, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-(3-thiophen-3-ylcyclohexen-1-yl)oxysilane is sourced from PubChem (CID 10562803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).