2-cyclohexylethyl-hydroxy-dimethoxysilane

C10H22O3Si — CID 20712687

IUPAC2-cyclohexylethyl-hydroxy-dimethoxysilane
SMILESCO[Si](O)(CCC1CCCCC1)OC
InChIInChI=1S/C10H22O3Si/c1-12-14(11,13-2)9-8-10-6-4-3-5-7-10/h10-11H,3-9H2,1-2H3
InChIKeyKRXBZBWHVRNHLB-UHFFFAOYSA-N
MW218.37 g/mol
LogP2.18
Rot. Bonds5

About 2-cyclohexylethyl-hydroxy-dimethoxysilane

2-cyclohexylethyl-hydroxy-dimethoxysilane (PubChem CID 20712687) has the molecular formula C10H22O3Si and a molecular weight of 218.37 g/mol. Its IUPAC name is 2-cyclohexylethyl-hydroxy-dimethoxysilane.

Molecular Properties

Compound Name2-cyclohexylethyl-hydroxy-dimethoxysilane
PubChem CID20712687
Molecular FormulaC10H22O3Si
Molecular Weight218.37 g/mol
Exact Mass218.13
IUPAC Name2-cyclohexylethyl-hydroxy-dimethoxysilane
SMILESCO[Si](O)(CCC1CCCCC1)OC
InChIInChI=1S/C10H22O3Si/c1-12-14(11,13-2)9-8-10-6-4-3-5-7-10/h10-11H,3-9H2,1-2H3
InChIKeyKRXBZBWHVRNHLB-UHFFFAOYSA-N
XLogP2.18
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.37
LogP ≤ 52.18
H-Bond Donors ≤ 51
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 2-cyclohexylethyl-hydroxy-dimethoxysilane?
The IUPAC name of 2-cyclohexylethyl-hydroxy-dimethoxysilane (CID 20712687) is 2-cyclohexylethyl-hydroxy-dimethoxysilane.
What is the SMILES notation for 2-cyclohexylethyl-hydroxy-dimethoxysilane?
The canonical SMILES for 2-cyclohexylethyl-hydroxy-dimethoxysilane is CO[Si](O)(CCC1CCCCC1)OC.
What is the InChIKey of 2-cyclohexylethyl-hydroxy-dimethoxysilane?
The InChIKey is KRXBZBWHVRNHLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22O3Si/c1-12-14(11,13-2)9-8-10-6-4-3-5-7-10/h10-11H,3-9H2,1-2H3.
What are the key properties of 2-cyclohexylethyl-hydroxy-dimethoxysilane?
2-cyclohexylethyl-hydroxy-dimethoxysilane has a molecular weight of 218.37 g/mol, XLogP of 2.18, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexylethyl-hydroxy-dimethoxysilane is sourced from PubChem (CID 20712687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).