cyclohexylmethyl-(2-ethylhexyl)-dimethoxysilane

C17H36O2Si — CID 18412961

IUPACcyclohexylmethyl-(2-ethylhexyl)-dimethoxysilane
SMILESCCCCC(CC)C[Si](CC1CCCCC1)(OC)OC
InChIInChI=1S/C17H36O2Si/c1-5-7-11-16(6-2)14-20(18-3,19-4)15-17-12-9-8-10-13-17/h16-17H,5-15H2,1-4H3
InChIKeyISJFGSZGDPHPCQ-UHFFFAOYSA-N
MW300.56 g/mol
LogP5.52
Rot. Bonds10

About cyclohexylmethyl-(2-ethylhexyl)-dimethoxysilane

cyclohexylmethyl-(2-ethylhexyl)-dimethoxysilane (PubChem CID 18412961) has the molecular formula C17H36O2Si and a molecular weight of 300.56 g/mol. Its IUPAC name is cyclohexylmethyl-(2-ethylhexyl)-dimethoxysilane.

Molecular Properties

Compound Namecyclohexylmethyl-(2-ethylhexyl)-dimethoxysilane
PubChem CID18412961
Molecular FormulaC17H36O2Si
Molecular Weight300.56 g/mol
Exact Mass300.25
IUPAC Namecyclohexylmethyl-(2-ethylhexyl)-dimethoxysilane
SMILESCCCCC(CC)C[Si](CC1CCCCC1)(OC)OC
InChIInChI=1S/C17H36O2Si/c1-5-7-11-16(6-2)14-20(18-3,19-4)15-17-12-9-8-10-13-17/h16-17H,5-15H2,1-4H3
InChIKeyISJFGSZGDPHPCQ-UHFFFAOYSA-N
XLogP5.52
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500300.56
LogP ≤ 55.52
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 cyclohexylmethyl-(2-ethylhexyl)-dimethoxysilane?
The IUPAC name of cyclohexylmethyl-(2-ethylhexyl)-dimethoxysilane (CID 18412961) is cyclohexylmethyl-(2-ethylhexyl)-dimethoxysilane.
What is the SMILES notation for cyclohexylmethyl-(2-ethylhexyl)-dimethoxysilane?
The canonical SMILES for cyclohexylmethyl-(2-ethylhexyl)-dimethoxysilane is CCCCC(CC)C[Si](CC1CCCCC1)(OC)OC.
What is the InChIKey of cyclohexylmethyl-(2-ethylhexyl)-dimethoxysilane?
The InChIKey is ISJFGSZGDPHPCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H36O2Si/c1-5-7-11-16(6-2)14-20(18-3,19-4)15-17-12-9-8-10-13-17/h16-17H,5-15H2,1-4H3.
What are the key properties of cyclohexylmethyl-(2-ethylhexyl)-dimethoxysilane?
cyclohexylmethyl-(2-ethylhexyl)-dimethoxysilane has a molecular weight of 300.56 g/mol, XLogP of 5.52, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexylmethyl-(2-ethylhexyl)-dimethoxysilane is sourced from PubChem (CID 18412961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).