cyclohexen-1-ylmethoxy-ethyl-dimethoxysilane

C11H22O3Si — CID 67704088

IUPACcyclohexen-1-ylmethoxy-ethyl-dimethoxysilane
SMILESCC[Si](OC)(OC)OCC1=CCCCC1
InChIInChI=1S/C11H22O3Si/c1-4-15(12-2,13-3)14-10-11-8-6-5-7-9-11/h8H,4-7,9-10H2,1-3H3
InChIKeyMAXDZKSWKGGVPW-UHFFFAOYSA-N
MW230.38 g/mol
LogP2.76
Rot. Bonds6

About cyclohexen-1-ylmethoxy-ethyl-dimethoxysilane

cyclohexen-1-ylmethoxy-ethyl-dimethoxysilane (PubChem CID 67704088) has the molecular formula C11H22O3Si and a molecular weight of 230.38 g/mol. Its IUPAC name is cyclohexen-1-ylmethoxy-ethyl-dimethoxysilane.

Molecular Properties

Compound Namecyclohexen-1-ylmethoxy-ethyl-dimethoxysilane
PubChem CID67704088
Molecular FormulaC11H22O3Si
Molecular Weight230.38 g/mol
Exact Mass230.13
IUPAC Namecyclohexen-1-ylmethoxy-ethyl-dimethoxysilane
SMILESCC[Si](OC)(OC)OCC1=CCCCC1
InChIInChI=1S/C11H22O3Si/c1-4-15(12-2,13-3)14-10-11-8-6-5-7-9-11/h8H,4-7,9-10H2,1-3H3
InChIKeyMAXDZKSWKGGVPW-UHFFFAOYSA-N
XLogP2.76
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.38
LogP ≤ 52.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of cyclohexen-1-ylmethoxy-ethyl-dimethoxysilane?
The IUPAC name of cyclohexen-1-ylmethoxy-ethyl-dimethoxysilane (CID 67704088) is cyclohexen-1-ylmethoxy-ethyl-dimethoxysilane.
What is the SMILES notation for cyclohexen-1-ylmethoxy-ethyl-dimethoxysilane?
The canonical SMILES for cyclohexen-1-ylmethoxy-ethyl-dimethoxysilane is CC[Si](OC)(OC)OCC1=CCCCC1.
What is the InChIKey of cyclohexen-1-ylmethoxy-ethyl-dimethoxysilane?
The InChIKey is MAXDZKSWKGGVPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22O3Si/c1-4-15(12-2,13-3)14-10-11-8-6-5-7-9-11/h8H,4-7,9-10H2,1-3H3.
What are the key properties of cyclohexen-1-ylmethoxy-ethyl-dimethoxysilane?
cyclohexen-1-ylmethoxy-ethyl-dimethoxysilane has a molecular weight of 230.38 g/mol, XLogP of 2.76, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexen-1-ylmethoxy-ethyl-dimethoxysilane is sourced from PubChem (CID 67704088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).