diethyl-hexoxy-(2-methylpentan-3-yloxy)silane

C16H36O2Si — CID 91739189

IUPACdiethyl-hexoxy-(2-methylpentan-3-yloxy)silane
SMILESCCCCCCO[Si](CC)(CC)OC(CC)C(C)C
InChIInChI=1S/C16H36O2Si/c1-7-11-12-13-14-17-19(9-3,10-4)18-16(8-2)15(5)6/h15-16H,7-14H2,1-6H3
InChIKeySKHBKEGGTFPPON-UHFFFAOYSA-N
MW288.55 g/mol
LogP5.52
Rot. Bonds12

About diethyl-hexoxy-(2-methylpentan-3-yloxy)silane

diethyl-hexoxy-(2-methylpentan-3-yloxy)silane (PubChem CID 91739189) has the molecular formula C16H36O2Si and a molecular weight of 288.55 g/mol. Its IUPAC name is diethyl-hexoxy-(2-methylpentan-3-yloxy)silane.

Molecular Properties

Compound Namediethyl-hexoxy-(2-methylpentan-3-yloxy)silane
PubChem CID91739189
Molecular FormulaC16H36O2Si
Molecular Weight288.55 g/mol
Exact Mass288.25
IUPAC Namediethyl-hexoxy-(2-methylpentan-3-yloxy)silane
SMILESCCCCCCO[Si](CC)(CC)OC(CC)C(C)C
InChIInChI=1S/C16H36O2Si/c1-7-11-12-13-14-17-19(9-3,10-4)18-16(8-2)15(5)6/h15-16H,7-14H2,1-6H3
InChIKeySKHBKEGGTFPPON-UHFFFAOYSA-N
XLogP5.52
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds12
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500288.55
LogP ≤ 55.52
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, dimethyldi(2-ethylhexyloxy)
CID 85694064
Silane, dimethyl(3-heptyloxy)isohexyloxy-
CID 91698390
Silane, diethyl(3,3-dimethylbut-2-yloxy)isohexyloxy-
CID 91698395
Silane, diethylisohexyloxy(2-methylbutoxy)-
CID 91698400
Silane, diethylisohexyloxy(4-methylpent-2-yloxy)-
CID 91698408
Silane, diethylisohexyloxy(2-octyloxy)-
CID 91698413
Silane, diethylisohexyloxy(4-octyloxy)-
CID 91698414
Silane, diethylisobutoxy(4-octyloxy)-
CID 91699659
Silane, diethylisobutoxy(2-methylpent-3-yloxy)-
CID 91699875
Silane, diethyl(6-ethyloct-3-yloxy)propoxy-
CID 91714695
Silane, diethyl(6-ethyloct-3-yloxy)pentyloxy-
CID 91723826
Silane, diethylhexyloxy(2-methyl-4-methoxybutoxy)-
CID 91730418

Frequently Asked Questions

What is the IUPAC name of diethyl-hexoxy-(2-methylpentan-3-yloxy)silane?
The IUPAC name of diethyl-hexoxy-(2-methylpentan-3-yloxy)silane (CID 91739189) is diethyl-hexoxy-(2-methylpentan-3-yloxy)silane.
What is the SMILES notation for diethyl-hexoxy-(2-methylpentan-3-yloxy)silane?
The canonical SMILES for diethyl-hexoxy-(2-methylpentan-3-yloxy)silane is CCCCCCO[Si](CC)(CC)OC(CC)C(C)C.
What is the InChIKey of diethyl-hexoxy-(2-methylpentan-3-yloxy)silane?
The InChIKey is SKHBKEGGTFPPON-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H36O2Si/c1-7-11-12-13-14-17-19(9-3,10-4)18-16(8-2)15(5)6/h15-16H,7-14H2,1-6H3.
What are the key properties of diethyl-hexoxy-(2-methylpentan-3-yloxy)silane?
diethyl-hexoxy-(2-methylpentan-3-yloxy)silane has a molecular weight of 288.55 g/mol, XLogP of 5.52, 12 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for diethyl-hexoxy-(2-methylpentan-3-yloxy)silane is sourced from PubChem (CID 91739189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).