diethyl-hexan-3-yloxy-hexoxysilane

C16H36O2Si — CID 91739192

IUPACdiethyl-hexan-3-yloxy-hexoxysilane
SMILESCCCCCCO[Si](CC)(CC)OC(CC)CCC
InChIInChI=1S/C16H36O2Si/c1-6-11-12-13-15-17-19(9-4,10-5)18-16(8-3)14-7-2/h16H,6-15H2,1-5H3
InChIKeyDSNHTBYJKKBXNA-UHFFFAOYSA-N
MW288.55 g/mol
LogP5.66
Rot. Bonds13

About diethyl-hexan-3-yloxy-hexoxysilane

diethyl-hexan-3-yloxy-hexoxysilane (PubChem CID 91739192) has the molecular formula C16H36O2Si and a molecular weight of 288.55 g/mol. Its IUPAC name is diethyl-hexan-3-yloxy-hexoxysilane.

Molecular Properties

Compound Namediethyl-hexan-3-yloxy-hexoxysilane
PubChem CID91739192
Molecular FormulaC16H36O2Si
Molecular Weight288.55 g/mol
Exact Mass288.25
IUPAC Namediethyl-hexan-3-yloxy-hexoxysilane
SMILESCCCCCCO[Si](CC)(CC)OC(CC)CCC
InChIInChI=1S/C16H36O2Si/c1-6-11-12-13-15-17-19(9-4,10-5)18-16(8-3)14-7-2/h16H,6-15H2,1-5H3
InChIKeyDSNHTBYJKKBXNA-UHFFFAOYSA-N
XLogP5.66
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds13
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500288.55
LogP ≤ 55.66
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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Frequently Asked Questions

What is the IUPAC name of diethyl-hexan-3-yloxy-hexoxysilane?
The IUPAC name of diethyl-hexan-3-yloxy-hexoxysilane (CID 91739192) is diethyl-hexan-3-yloxy-hexoxysilane.
What is the SMILES notation for diethyl-hexan-3-yloxy-hexoxysilane?
The canonical SMILES for diethyl-hexan-3-yloxy-hexoxysilane is CCCCCCO[Si](CC)(CC)OC(CC)CCC.
What is the InChIKey of diethyl-hexan-3-yloxy-hexoxysilane?
The InChIKey is DSNHTBYJKKBXNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H36O2Si/c1-6-11-12-13-15-17-19(9-4,10-5)18-16(8-3)14-7-2/h16H,6-15H2,1-5H3.
What are the key properties of diethyl-hexan-3-yloxy-hexoxysilane?
diethyl-hexan-3-yloxy-hexoxysilane has a molecular weight of 288.55 g/mol, XLogP of 5.66, 13 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for diethyl-hexan-3-yloxy-hexoxysilane is sourced from PubChem (CID 91739192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).