trihydroxy(octyl)silane

C8H20O3Si — CID 11564621

IUPACtrihydroxy(octyl)silane
SMILESCCCCCCCC[Si](O)(O)O
InChIInChI=1S/C8H20O3Si/c1-2-3-4-5-6-7-8-12(9,10)11/h9-11H,2-8H2,1H3
InChIKeyYLZZRAHVHXTKGO-UHFFFAOYSA-N
MW192.33 g/mol
LogP1.26
Rot. Bonds7

About trihydroxy(octyl)silane

trihydroxy(octyl)silane (PubChem CID 11564621) has the molecular formula C8H20O3Si and a molecular weight of 192.33 g/mol. Its IUPAC name is trihydroxy(octyl)silane.

Molecular Properties

Compound Nametrihydroxy(octyl)silane
PubChem CID11564621
Molecular FormulaC8H20O3Si
Molecular Weight192.33 g/mol
Exact Mass192.12
IUPAC Nametrihydroxy(octyl)silane
SMILESCCCCCCCC[Si](O)(O)O
InChIInChI=1S/C8H20O3Si/c1-2-3-4-5-6-7-8-12(9,10)11/h9-11H,2-8H2,1H3
InChIKeyYLZZRAHVHXTKGO-UHFFFAOYSA-N
XLogP1.26
TPSA60.69 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.33
LogP ≤ 51.26
H-Bond Donors ≤ 53
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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Frequently Asked Questions

What is the IUPAC name of trihydroxy(octyl)silane?
The IUPAC name of trihydroxy(octyl)silane (CID 11564621) is trihydroxy(octyl)silane.
What is the SMILES notation for trihydroxy(octyl)silane?
The canonical SMILES for trihydroxy(octyl)silane is CCCCCCCC[Si](O)(O)O.
What is the InChIKey of trihydroxy(octyl)silane?
The InChIKey is YLZZRAHVHXTKGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H20O3Si/c1-2-3-4-5-6-7-8-12(9,10)11/h9-11H,2-8H2,1H3.
What are the key properties of trihydroxy(octyl)silane?
trihydroxy(octyl)silane has a molecular weight of 192.33 g/mol, XLogP of 1.26, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for trihydroxy(octyl)silane is sourced from PubChem (CID 11564621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).