2-ethylhexoxy-hydroxy-oxosilane

C8H18O3Si — CID 19382926

IUPAC2-ethylhexoxy-hydroxy-oxosilane
SMILESCCCCC(CC)CO[Si](=O)O
InChIInChI=1S/C8H18O3Si/c1-3-5-6-8(4-2)7-11-12(9)10/h8-9H,3-7H2,1-2H3
InChIKeySQGUQDBAWRNYOO-UHFFFAOYSA-N
MW190.31 g/mol
LogP1.63
Rot. Bonds7

About 2-ethylhexoxy-hydroxy-oxosilane

2-ethylhexoxy-hydroxy-oxosilane (PubChem CID 19382926) has the molecular formula C8H18O3Si and a molecular weight of 190.31 g/mol. Its IUPAC name is 2-ethylhexoxy-hydroxy-oxosilane.

Molecular Properties

Compound Name2-ethylhexoxy-hydroxy-oxosilane
PubChem CID19382926
Molecular FormulaC8H18O3Si
Molecular Weight190.31 g/mol
Exact Mass190.10
IUPAC Name2-ethylhexoxy-hydroxy-oxosilane
SMILESCCCCC(CC)CO[Si](=O)O
InChIInChI=1S/C8H18O3Si/c1-3-5-6-8(4-2)7-11-12(9)10/h8-9H,3-7H2,1-2H3
InChIKeySQGUQDBAWRNYOO-UHFFFAOYSA-N
XLogP1.63
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.31
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-ethylhexoxy-hydroxy-oxosilane?
The IUPAC name of 2-ethylhexoxy-hydroxy-oxosilane (CID 19382926) is 2-ethylhexoxy-hydroxy-oxosilane.
What is the SMILES notation for 2-ethylhexoxy-hydroxy-oxosilane?
The canonical SMILES for 2-ethylhexoxy-hydroxy-oxosilane is CCCCC(CC)CO[Si](=O)O.
What is the InChIKey of 2-ethylhexoxy-hydroxy-oxosilane?
The InChIKey is SQGUQDBAWRNYOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18O3Si/c1-3-5-6-8(4-2)7-11-12(9)10/h8-9H,3-7H2,1-2H3.
What are the key properties of 2-ethylhexoxy-hydroxy-oxosilane?
2-ethylhexoxy-hydroxy-oxosilane has a molecular weight of 190.31 g/mol, XLogP of 1.63, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethylhexoxy-hydroxy-oxosilane is sourced from PubChem (CID 19382926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).