diethyl-(2-ethylhexoxy)-hexoxysilane

C18H40O2Si — CID 91741068

IUPACdiethyl-(2-ethylhexoxy)-hexoxysilane
SMILESCCCCCCO[Si](CC)(CC)OCC(CC)CCCC
InChIInChI=1S/C18H40O2Si/c1-6-11-13-14-16-19-21(9-4,10-5)20-17-18(8-3)15-12-7-2/h18H,6-17H2,1-5H3
InChIKeyOTWXCWUTZGZPLU-UHFFFAOYSA-N
MW316.60 g/mol
LogP6.30
Rot. Bonds15

About diethyl-(2-ethylhexoxy)-hexoxysilane

diethyl-(2-ethylhexoxy)-hexoxysilane (PubChem CID 91741068) has the molecular formula C18H40O2Si and a molecular weight of 316.60 g/mol. Its IUPAC name is diethyl-(2-ethylhexoxy)-hexoxysilane.

Molecular Properties

Compound Namediethyl-(2-ethylhexoxy)-hexoxysilane
PubChem CID91741068
Molecular FormulaC18H40O2Si
Molecular Weight316.60 g/mol
Exact Mass316.28
IUPAC Namediethyl-(2-ethylhexoxy)-hexoxysilane
SMILESCCCCCCO[Si](CC)(CC)OCC(CC)CCCC
InChIInChI=1S/C18H40O2Si/c1-6-11-13-14-16-19-21(9-4,10-5)20-17-18(8-3)15-12-7-2/h18H,6-17H2,1-5H3
InChIKeyOTWXCWUTZGZPLU-UHFFFAOYSA-N
XLogP6.30
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds15
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500316.60
LogP ≤ 56.30
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

Bis(2-ethylbutyl) bis(2-ethylhexyl) orthosilicate
CID 112013
Silane, dimethyldi(2-ethylhexyloxy)
CID 85694064
Silane, [(2-ethylhexyl)oxy]trimethyl-
CID 554452
Silane, methylvinyldi(2-ethylhexyloxy)-
CID 23213487
tert-butyl-dimethyl-[(3S)-3-methylundecoxy]silane
CID 11312646
(s)-t-Butyl(dimethyl)[(13-methylheptadecyl)oxy]silane
CID 146679947
Silane, methylvinyldi(3,7-dimethyloctyloxy)-
CID 91698190
Silane, dimethyl(3-methylpentyloxy)isohexyloxy-
CID 91698399
Silane, diethylisohexyloxy(2-methylbutoxy)-
CID 91698400
Silane, methylvinyl(3,7-dimethyloctyloxy)isobutoxy-
CID 91698410
Silane, methylvinyl(3,7-dimethyloctyloxy)butoxy-
CID 91698411
Silane, diethylisohexyloxy(2-octyloxy)-
CID 91698413

Frequently Asked Questions

What is the IUPAC name of diethyl-(2-ethylhexoxy)-hexoxysilane?
The IUPAC name of diethyl-(2-ethylhexoxy)-hexoxysilane (CID 91741068) is diethyl-(2-ethylhexoxy)-hexoxysilane.
What is the SMILES notation for diethyl-(2-ethylhexoxy)-hexoxysilane?
The canonical SMILES for diethyl-(2-ethylhexoxy)-hexoxysilane is CCCCCCO[Si](CC)(CC)OCC(CC)CCCC.
What is the InChIKey of diethyl-(2-ethylhexoxy)-hexoxysilane?
The InChIKey is OTWXCWUTZGZPLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H40O2Si/c1-6-11-13-14-16-19-21(9-4,10-5)20-17-18(8-3)15-12-7-2/h18H,6-17H2,1-5H3.
What are the key properties of diethyl-(2-ethylhexoxy)-hexoxysilane?
diethyl-(2-ethylhexoxy)-hexoxysilane has a molecular weight of 316.60 g/mol, XLogP of 6.30, 15 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for diethyl-(2-ethylhexoxy)-hexoxysilane is sourced from PubChem (CID 91741068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).