butoxy-dibutyl-ethylsilane

C14H32OSi — CID 141095554

IUPACbutoxy-dibutyl-ethylsilane
SMILESCCCCO[Si](CC)(CCCC)CCCC
InChIInChI=1S/C14H32OSi/c1-5-9-12-15-16(8-4,13-10-6-2)14-11-7-3/h5-14H2,1-4H3
InChIKeyBPEGTYAJJRVTGL-UHFFFAOYSA-N
MW244.49 g/mol
LogP5.37
Rot. Bonds11

About butoxy-dibutyl-ethylsilane

butoxy-dibutyl-ethylsilane (PubChem CID 141095554) has the molecular formula C14H32OSi and a molecular weight of 244.49 g/mol. Its IUPAC name is butoxy-dibutyl-ethylsilane.

Molecular Properties

Compound Namebutoxy-dibutyl-ethylsilane
PubChem CID141095554
Molecular FormulaC14H32OSi
Molecular Weight244.49 g/mol
Exact Mass244.22
IUPAC Namebutoxy-dibutyl-ethylsilane
SMILESCCCCO[Si](CC)(CCCC)CCCC
InChIInChI=1S/C14H32OSi/c1-5-9-12-15-16(8-4,13-10-6-2)14-11-7-3/h5-14H2,1-4H3
InChIKeyBPEGTYAJJRVTGL-UHFFFAOYSA-N
XLogP5.37
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds11
Heavy Atoms16
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500244.49
LogP ≤ 55.37
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 butoxy-dibutyl-ethylsilane?
The IUPAC name of butoxy-dibutyl-ethylsilane (CID 141095554) is butoxy-dibutyl-ethylsilane.
What is the SMILES notation for butoxy-dibutyl-ethylsilane?
The canonical SMILES for butoxy-dibutyl-ethylsilane is CCCCO[Si](CC)(CCCC)CCCC.
What is the InChIKey of butoxy-dibutyl-ethylsilane?
The InChIKey is BPEGTYAJJRVTGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H32OSi/c1-5-9-12-15-16(8-4,13-10-6-2)14-11-7-3/h5-14H2,1-4H3.
What are the key properties of butoxy-dibutyl-ethylsilane?
butoxy-dibutyl-ethylsilane has a molecular weight of 244.49 g/mol, XLogP of 5.37, 11 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for butoxy-dibutyl-ethylsilane is sourced from PubChem (CID 141095554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).