diethyl-(4-methylcyclohexyl)oxy-nonoxysilane

C20H42O2Si — CID 91742122

IUPACdiethyl-(4-methylcyclohexyl)oxy-nonoxysilane
SMILESCCCCCCCCCO[Si](CC)(CC)OC1CCC(C)CC1
InChIInChI=1S/C20H42O2Si/c1-5-8-9-10-11-12-13-18-21-23(6-2,7-3)22-20-16-14-19(4)15-17-20/h19-20H,5-18H2,1-4H3
InChIKeyUDXINWAMAWRFMZ-UHFFFAOYSA-N
MW342.64 g/mol
LogP6.83
Rot. Bonds13

About diethyl-(4-methylcyclohexyl)oxy-nonoxysilane

diethyl-(4-methylcyclohexyl)oxy-nonoxysilane (PubChem CID 91742122) has the molecular formula C20H42O2Si and a molecular weight of 342.64 g/mol. Its IUPAC name is diethyl-(4-methylcyclohexyl)oxy-nonoxysilane.

Molecular Properties

Compound Namediethyl-(4-methylcyclohexyl)oxy-nonoxysilane
PubChem CID91742122
Molecular FormulaC20H42O2Si
Molecular Weight342.64 g/mol
Exact Mass342.30
IUPAC Namediethyl-(4-methylcyclohexyl)oxy-nonoxysilane
SMILESCCCCCCCCCO[Si](CC)(CC)OC1CCC(C)CC1
InChIInChI=1S/C20H42O2Si/c1-5-8-9-10-11-12-13-18-21-23(6-2,7-3)22-20-16-14-19(4)15-17-20/h19-20H,5-18H2,1-4H3
InChIKeyUDXINWAMAWRFMZ-UHFFFAOYSA-N
XLogP6.83
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds13
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500342.64
LogP ≤ 56.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

Silane, trimethyl[(4-methylcyclohexyl)oxy]-, trans-
CID 520561
Ethyl 5-(sec-butylsulfanyl)-3-(4-chlorophenyl)-4-cyano-2-thiophenecarboxylate
CID 529215
[2-(2-Cyclohexylethoxy)-3-fluoropropyl]-tri(propan-2-yl)silane
CID 101955855
tert-butyl-[(1R,2R)-2-hex-2-ynylcyclohexyl]oxy-dimethylsilane
CID 134978254
Tert-butyl-(4-tert-butylcyclohexyl)oxy-dimethylsilane
CID 11021977
Tert-butyl-[4-[(3-fluorocyclohexyl)methyl]cyclohexyl]oxy-dimethylsilane
CID 140449683
Tert-butyl-[4-[(3-fluoro-4-methoxycyclohexyl)methyl]cyclohexyl]oxy-dimethylsilane
CID 140449789
Cyclohexanol, 2-methyl, DMTBS
CID 529214
Silane, diethylisohexyloxy(2-octyloxy)-
CID 91698413
Silane, diethylisohexyloxy(4-octyloxy)-
CID 91698414
Silane, diethyl(cis-4-methylcyclohexyloxy)(trans-4-methylcyclohexyloxy)-
CID 91699932
Silane, diethyl(6-ethyloct-3-yloxy)propoxy-
CID 91714695

Frequently Asked Questions

What is the IUPAC name of diethyl-(4-methylcyclohexyl)oxy-nonoxysilane?
The IUPAC name of diethyl-(4-methylcyclohexyl)oxy-nonoxysilane (CID 91742122) is diethyl-(4-methylcyclohexyl)oxy-nonoxysilane.
What is the SMILES notation for diethyl-(4-methylcyclohexyl)oxy-nonoxysilane?
The canonical SMILES for diethyl-(4-methylcyclohexyl)oxy-nonoxysilane is CCCCCCCCCO[Si](CC)(CC)OC1CCC(C)CC1.
What is the InChIKey of diethyl-(4-methylcyclohexyl)oxy-nonoxysilane?
The InChIKey is UDXINWAMAWRFMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H42O2Si/c1-5-8-9-10-11-12-13-18-21-23(6-2,7-3)22-20-16-14-19(4)15-17-20/h19-20H,5-18H2,1-4H3.
What are the key properties of diethyl-(4-methylcyclohexyl)oxy-nonoxysilane?
diethyl-(4-methylcyclohexyl)oxy-nonoxysilane has a molecular weight of 342.64 g/mol, XLogP of 6.83, 13 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for diethyl-(4-methylcyclohexyl)oxy-nonoxysilane is sourced from PubChem (CID 91742122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).