[2-(3-ethyloxetan-3-yl)-2-propoxybutyl]-dimethoxysilane

C14H30O4Si — CID 173225842

IUPAC[2-(3-ethyloxetan-3-yl)-2-propoxybutyl]-dimethoxysilane
SMILESCCCOC(CC)(C[SiH](OC)OC)C1(CC)COC1
InChIInChI=1S/C14H30O4Si/c1-6-9-18-14(8-3,12-19(15-4)16-5)13(7-2)10-17-11-13/h19H,6-12H2,1-5H3
InChIKeyCTSCQFCFSSQGNQ-UHFFFAOYSA-N
MW290.48 g/mol
LogP2.50
Rot. Bonds10

About [2-(3-ethyloxetan-3-yl)-2-propoxybutyl]-dimethoxysilane

[2-(3-ethyloxetan-3-yl)-2-propoxybutyl]-dimethoxysilane (PubChem CID 173225842) has the molecular formula C14H30O4Si and a molecular weight of 290.48 g/mol. Its IUPAC name is [2-(3-ethyloxetan-3-yl)-2-propoxybutyl]-dimethoxysilane.

Molecular Properties

Compound Name[2-(3-ethyloxetan-3-yl)-2-propoxybutyl]-dimethoxysilane
PubChem CID173225842
Molecular FormulaC14H30O4Si
Molecular Weight290.48 g/mol
Exact Mass290.19
IUPAC Name[2-(3-ethyloxetan-3-yl)-2-propoxybutyl]-dimethoxysilane
SMILESCCCOC(CC)(C[SiH](OC)OC)C1(CC)COC1
InChIInChI=1S/C14H30O4Si/c1-6-9-18-14(8-3,12-19(15-4)16-5)13(7-2)10-17-11-13/h19H,6-12H2,1-5H3
InChIKeyCTSCQFCFSSQGNQ-UHFFFAOYSA-N
XLogP2.50
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.48
LogP ≤ 52.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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-(3-ethyloxetan-3-yl)-2-propoxybutyl]-dimethoxysilane?
The IUPAC name of [2-(3-ethyloxetan-3-yl)-2-propoxybutyl]-dimethoxysilane (CID 173225842) is [2-(3-ethyloxetan-3-yl)-2-propoxybutyl]-dimethoxysilane.
What is the SMILES notation for [2-(3-ethyloxetan-3-yl)-2-propoxybutyl]-dimethoxysilane?
The canonical SMILES for [2-(3-ethyloxetan-3-yl)-2-propoxybutyl]-dimethoxysilane is CCCOC(CC)(C[SiH](OC)OC)C1(CC)COC1.
What is the InChIKey of [2-(3-ethyloxetan-3-yl)-2-propoxybutyl]-dimethoxysilane?
The InChIKey is CTSCQFCFSSQGNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30O4Si/c1-6-9-18-14(8-3,12-19(15-4)16-5)13(7-2)10-17-11-13/h19H,6-12H2,1-5H3.
What are the key properties of [2-(3-ethyloxetan-3-yl)-2-propoxybutyl]-dimethoxysilane?
[2-(3-ethyloxetan-3-yl)-2-propoxybutyl]-dimethoxysilane has a molecular weight of 290.48 g/mol, XLogP of 2.50, 10 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(3-ethyloxetan-3-yl)-2-propoxybutyl]-dimethoxysilane is sourced from PubChem (CID 173225842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).