cyclohexen-1-yloxy-ethenyl-diethoxysilane

C12H22O3Si — CID 54166927

IUPACcyclohexen-1-yloxy-ethenyl-diethoxysilane
SMILESC=C[Si](OCC)(OCC)OC1=CCCCC1
InChIInChI=1S/C12H22O3Si/c1-4-13-16(6-3,14-5-2)15-12-10-8-7-9-11-12/h6,10H,3-5,7-9,11H2,1-2H3
InChIKeyOSHJDIRULYNQBT-UHFFFAOYSA-N
MW242.39 g/mol
LogP3.20
Rot. Bonds7

About cyclohexen-1-yloxy-ethenyl-diethoxysilane

cyclohexen-1-yloxy-ethenyl-diethoxysilane (PubChem CID 54166927) has the molecular formula C12H22O3Si and a molecular weight of 242.39 g/mol. Its IUPAC name is cyclohexen-1-yloxy-ethenyl-diethoxysilane.

Molecular Properties

Compound Namecyclohexen-1-yloxy-ethenyl-diethoxysilane
PubChem CID54166927
Molecular FormulaC12H22O3Si
Molecular Weight242.39 g/mol
Exact Mass242.13
IUPAC Namecyclohexen-1-yloxy-ethenyl-diethoxysilane
SMILESC=C[Si](OCC)(OCC)OC1=CCCCC1
InChIInChI=1S/C12H22O3Si/c1-4-13-16(6-3,14-5-2)15-12-10-8-7-9-11-12/h6,10H,3-5,7-9,11H2,1-2H3
InChIKeyOSHJDIRULYNQBT-UHFFFAOYSA-N
XLogP3.20
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.39
LogP ≤ 53.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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 cyclohexen-1-yloxy-ethenyl-diethoxysilane?
The IUPAC name of cyclohexen-1-yloxy-ethenyl-diethoxysilane (CID 54166927) is cyclohexen-1-yloxy-ethenyl-diethoxysilane.
What is the SMILES notation for cyclohexen-1-yloxy-ethenyl-diethoxysilane?
The canonical SMILES for cyclohexen-1-yloxy-ethenyl-diethoxysilane is C=C[Si](OCC)(OCC)OC1=CCCCC1.
What is the InChIKey of cyclohexen-1-yloxy-ethenyl-diethoxysilane?
The InChIKey is OSHJDIRULYNQBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22O3Si/c1-4-13-16(6-3,14-5-2)15-12-10-8-7-9-11-12/h6,10H,3-5,7-9,11H2,1-2H3.
What are the key properties of cyclohexen-1-yloxy-ethenyl-diethoxysilane?
cyclohexen-1-yloxy-ethenyl-diethoxysilane has a molecular weight of 242.39 g/mol, XLogP of 3.20, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexen-1-yloxy-ethenyl-diethoxysilane is sourced from PubChem (CID 54166927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).