diethyl-bis[(4-methylcyclohexyl)oxy]silane

C18H36O2Si — CID 91699932

IUPACdiethyl-bis[(4-methylcyclohexyl)oxy]silane
SMILESCC[Si](CC)(OC1CCC(C)CC1)OC1CCC(C)CC1
InChIInChI=1S/C18H36O2Si/c1-5-21(6-2,19-17-11-7-15(3)8-12-17)20-18-13-9-16(4)10-14-18/h15-18H,5-14H2,1-4H3
InChIKeySXSAAPIOWJSHHA-UHFFFAOYSA-N
MW312.57 g/mol
LogP5.66
Rot. Bonds6

About diethyl-bis[(4-methylcyclohexyl)oxy]silane

diethyl-bis[(4-methylcyclohexyl)oxy]silane (PubChem CID 91699932) has the molecular formula C18H36O2Si and a molecular weight of 312.57 g/mol. Its IUPAC name is diethyl-bis[(4-methylcyclohexyl)oxy]silane.

Molecular Properties

Compound Namediethyl-bis[(4-methylcyclohexyl)oxy]silane
PubChem CID91699932
Molecular FormulaC18H36O2Si
Molecular Weight312.57 g/mol
Exact Mass312.25
IUPAC Namediethyl-bis[(4-methylcyclohexyl)oxy]silane
SMILESCC[Si](CC)(OC1CCC(C)CC1)OC1CCC(C)CC1
InChIInChI=1S/C18H36O2Si/c1-5-21(6-2,19-17-11-7-15(3)8-12-17)20-18-13-9-16(4)10-14-18/h15-18H,5-14H2,1-4H3
InChIKeySXSAAPIOWJSHHA-UHFFFAOYSA-N
XLogP5.66
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500312.57
LogP ≤ 55.66
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 diethyl-bis[(4-methylcyclohexyl)oxy]silane?
The IUPAC name of diethyl-bis[(4-methylcyclohexyl)oxy]silane (CID 91699932) is diethyl-bis[(4-methylcyclohexyl)oxy]silane.
What is the SMILES notation for diethyl-bis[(4-methylcyclohexyl)oxy]silane?
The canonical SMILES for diethyl-bis[(4-methylcyclohexyl)oxy]silane is CC[Si](CC)(OC1CCC(C)CC1)OC1CCC(C)CC1.
What is the InChIKey of diethyl-bis[(4-methylcyclohexyl)oxy]silane?
The InChIKey is SXSAAPIOWJSHHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H36O2Si/c1-5-21(6-2,19-17-11-7-15(3)8-12-17)20-18-13-9-16(4)10-14-18/h15-18H,5-14H2,1-4H3.
What are the key properties of diethyl-bis[(4-methylcyclohexyl)oxy]silane?
diethyl-bis[(4-methylcyclohexyl)oxy]silane has a molecular weight of 312.57 g/mol, XLogP of 5.66, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for diethyl-bis[(4-methylcyclohexyl)oxy]silane is sourced from PubChem (CID 91699932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).