2-(2-cyclohexylethyl)-2-methyl-1,3,2,4-dioxadisiletane

C9H20O2Si2 — CID 123227097

IUPAC2-(2-cyclohexylethyl)-2-methyl-1,3,2,4-dioxadisiletane
SMILESC[Si]1(CCC2CCCCC2)O[SiH2]O1
InChIInChI=1S/C9H20O2Si2/c1-13(10-12-11-13)8-7-9-5-3-2-4-6-9/h9H,2-8,12H2,1H3
InChIKeyRCQVGDVKNZHWES-UHFFFAOYSA-N
MW216.43 g/mol
LogP2.07
Rot. Bonds3

About 2-(2-cyclohexylethyl)-2-methyl-1,3,2,4-dioxadisiletane

2-(2-cyclohexylethyl)-2-methyl-1,3,2,4-dioxadisiletane (PubChem CID 123227097) has the molecular formula C9H20O2Si2 and a molecular weight of 216.43 g/mol. Its IUPAC name is 2-(2-cyclohexylethyl)-2-methyl-1,3,2,4-dioxadisiletane.

Molecular Properties

Compound Name2-(2-cyclohexylethyl)-2-methyl-1,3,2,4-dioxadisiletane
PubChem CID123227097
Molecular FormulaC9H20O2Si2
Molecular Weight216.43 g/mol
Exact Mass216.10
IUPAC Name2-(2-cyclohexylethyl)-2-methyl-1,3,2,4-dioxadisiletane
SMILESC[Si]1(CCC2CCCCC2)O[SiH2]O1
InChIInChI=1S/C9H20O2Si2/c1-13(10-12-11-13)8-7-9-5-3-2-4-6-9/h9H,2-8,12H2,1H3
InChIKeyRCQVGDVKNZHWES-UHFFFAOYSA-N
XLogP2.07
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.43
LogP ≤ 52.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 2-(2-cyclohexylethyl)-2-methyl-1,3,2,4-dioxadisiletane?
The IUPAC name of 2-(2-cyclohexylethyl)-2-methyl-1,3,2,4-dioxadisiletane (CID 123227097) is 2-(2-cyclohexylethyl)-2-methyl-1,3,2,4-dioxadisiletane.
What is the SMILES notation for 2-(2-cyclohexylethyl)-2-methyl-1,3,2,4-dioxadisiletane?
The canonical SMILES for 2-(2-cyclohexylethyl)-2-methyl-1,3,2,4-dioxadisiletane is C[Si]1(CCC2CCCCC2)O[SiH2]O1.
What is the InChIKey of 2-(2-cyclohexylethyl)-2-methyl-1,3,2,4-dioxadisiletane?
The InChIKey is RCQVGDVKNZHWES-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20O2Si2/c1-13(10-12-11-13)8-7-9-5-3-2-4-6-9/h9H,2-8,12H2,1H3.
What are the key properties of 2-(2-cyclohexylethyl)-2-methyl-1,3,2,4-dioxadisiletane?
2-(2-cyclohexylethyl)-2-methyl-1,3,2,4-dioxadisiletane has a molecular weight of 216.43 g/mol, XLogP of 2.07, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyclohexylethyl)-2-methyl-1,3,2,4-dioxadisiletane is sourced from PubChem (CID 123227097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).