octyl(oxan-2-yl)silane

C13H28OSi — CID 123611603

IUPACoctyl(oxan-2-yl)silane
SMILESCCCCCCCC[SiH2]C1CCCCO1
InChIInChI=1S/C13H28OSi/c1-2-3-4-5-6-9-12-15-13-10-7-8-11-14-13/h13H,2-12,15H2,1H3
InChIKeyLSZSVEPSVJIMBN-UHFFFAOYSA-N
MW228.45 g/mol
LogP3.46
Rot. Bonds8

About octyl(oxan-2-yl)silane

octyl(oxan-2-yl)silane (PubChem CID 123611603) has the molecular formula C13H28OSi and a molecular weight of 228.45 g/mol. Its IUPAC name is octyl(oxan-2-yl)silane.

Molecular Properties

Compound Nameoctyl(oxan-2-yl)silane
PubChem CID123611603
Molecular FormulaC13H28OSi
Molecular Weight228.45 g/mol
Exact Mass228.19
IUPAC Nameoctyl(oxan-2-yl)silane
SMILESCCCCCCCC[SiH2]C1CCCCO1
InChIInChI=1S/C13H28OSi/c1-2-3-4-5-6-9-12-15-13-10-7-8-11-14-13/h13H,2-12,15H2,1H3
InChIKeyLSZSVEPSVJIMBN-UHFFFAOYSA-N
XLogP3.46
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.45
LogP ≤ 53.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 octyl(oxan-2-yl)silane?
The IUPAC name of octyl(oxan-2-yl)silane (CID 123611603) is octyl(oxan-2-yl)silane.
What is the SMILES notation for octyl(oxan-2-yl)silane?
The canonical SMILES for octyl(oxan-2-yl)silane is CCCCCCCC[SiH2]C1CCCCO1.
What is the InChIKey of octyl(oxan-2-yl)silane?
The InChIKey is LSZSVEPSVJIMBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28OSi/c1-2-3-4-5-6-9-12-15-13-10-7-8-11-14-13/h13H,2-12,15H2,1H3.
What are the key properties of octyl(oxan-2-yl)silane?
octyl(oxan-2-yl)silane has a molecular weight of 228.45 g/mol, XLogP of 3.46, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for octyl(oxan-2-yl)silane is sourced from PubChem (CID 123611603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).