[dimethyl(4-methylpentoxy)silyl]oxy-(2-ethylhexoxy)-dimethylsilane

C18H42O3Si2 — CID 91737021

IUPAC[dimethyl(4-methylpentoxy)silyl]oxy-(2-ethylhexoxy)-dimethylsilane
SMILESCCCCC(CC)CO[Si](C)(C)O[Si](C)(C)OCCCC(C)C
InChIInChI=1S/C18H42O3Si2/c1-9-11-14-18(10-2)16-20-23(7,8)21-22(5,6)19-15-12-13-17(3)4/h17-18H,9-16H2,1-8H3
InChIKeyGSSQUKPRFYDFJF-UHFFFAOYSA-N
MW362.70 g/mol
LogP6.09
Rot. Bonds14

About [dimethyl(4-methylpentoxy)silyl]oxy-(2-ethylhexoxy)-dimethylsilane

[dimethyl(4-methylpentoxy)silyl]oxy-(2-ethylhexoxy)-dimethylsilane (PubChem CID 91737021) has the molecular formula C18H42O3Si2 and a molecular weight of 362.70 g/mol. Its IUPAC name is [dimethyl(4-methylpentoxy)silyl]oxy-(2-ethylhexoxy)-dimethylsilane.

Molecular Properties

Compound Name[dimethyl(4-methylpentoxy)silyl]oxy-(2-ethylhexoxy)-dimethylsilane
PubChem CID91737021
Molecular FormulaC18H42O3Si2
Molecular Weight362.70 g/mol
Exact Mass362.27
IUPAC Name[dimethyl(4-methylpentoxy)silyl]oxy-(2-ethylhexoxy)-dimethylsilane
SMILESCCCCC(CC)CO[Si](C)(C)O[Si](C)(C)OCCCC(C)C
InChIInChI=1S/C18H42O3Si2/c1-9-11-14-18(10-2)16-20-23(7,8)21-22(5,6)19-15-12-13-17(3)4/h17-18H,9-16H2,1-8H3
InChIKeyGSSQUKPRFYDFJF-UHFFFAOYSA-N
XLogP6.09
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds14
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500362.70
LogP ≤ 56.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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
Cyclohexylmethoxy-dimethylsilyloxy-dimethylsilane
CID 101900131
tert-butyl-dimethyl-[(3S)-3-methylundecoxy]silane
CID 11312646
(s)-t-Butyl(dimethyl)[(13-methylheptadecyl)oxy]silane
CID 146679947
Silane, dimethyl(3-methylpentyloxy)isohexyloxy-
CID 91698399
Silane, diethyl(6-ethyloct-3-yloxy)propoxy-
CID 91714695
Silane, dimethyl(dimethyl(2-ethylbutoxy)silyloxy)dodecyloxy-
CID 91721100
Silane, dimethyl(dimethyl(2-ethylhexyloxy)silyloxy)isobutoxy-
CID 91721103
Silane, dimethyl(dimethyl(2-methylbutoxy)silyloxy)isohexyloxy-
CID 91721105

Frequently Asked Questions

What is the IUPAC name of [dimethyl(4-methylpentoxy)silyl]oxy-(2-ethylhexoxy)-dimethylsilane?
The IUPAC name of [dimethyl(4-methylpentoxy)silyl]oxy-(2-ethylhexoxy)-dimethylsilane (CID 91737021) is [dimethyl(4-methylpentoxy)silyl]oxy-(2-ethylhexoxy)-dimethylsilane.
What is the SMILES notation for [dimethyl(4-methylpentoxy)silyl]oxy-(2-ethylhexoxy)-dimethylsilane?
The canonical SMILES for [dimethyl(4-methylpentoxy)silyl]oxy-(2-ethylhexoxy)-dimethylsilane is CCCCC(CC)CO[Si](C)(C)O[Si](C)(C)OCCCC(C)C.
What is the InChIKey of [dimethyl(4-methylpentoxy)silyl]oxy-(2-ethylhexoxy)-dimethylsilane?
The InChIKey is GSSQUKPRFYDFJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H42O3Si2/c1-9-11-14-18(10-2)16-20-23(7,8)21-22(5,6)19-15-12-13-17(3)4/h17-18H,9-16H2,1-8H3.
What are the key properties of [dimethyl(4-methylpentoxy)silyl]oxy-(2-ethylhexoxy)-dimethylsilane?
[dimethyl(4-methylpentoxy)silyl]oxy-(2-ethylhexoxy)-dimethylsilane has a molecular weight of 362.70 g/mol, XLogP of 6.09, 14 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [dimethyl(4-methylpentoxy)silyl]oxy-(2-ethylhexoxy)-dimethylsilane is sourced from PubChem (CID 91737021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).