tert-butyl-methoxy-octylsilane

C13H30OSi — CID 154374497

IUPACtert-butyl-methoxy-octylsilane
SMILESCCCCCCCC[SiH](OC)C(C)(C)C
InChIInChI=1S/C13H30OSi/c1-6-7-8-9-10-11-12-15(14-5)13(2,3)4/h15H,6-12H2,1-5H3
InChIKeyJSJNJYNDDAXWCZ-UHFFFAOYSA-N
MW230.47 g/mol
LogP4.52
Rot. Bonds8

About tert-butyl-methoxy-octylsilane

tert-butyl-methoxy-octylsilane (PubChem CID 154374497) has the molecular formula C13H30OSi and a molecular weight of 230.47 g/mol. Its IUPAC name is tert-butyl-methoxy-octylsilane.

Molecular Properties

Compound Nametert-butyl-methoxy-octylsilane
PubChem CID154374497
Molecular FormulaC13H30OSi
Molecular Weight230.47 g/mol
Exact Mass230.21
IUPAC Nametert-butyl-methoxy-octylsilane
SMILESCCCCCCCC[SiH](OC)C(C)(C)C
InChIInChI=1S/C13H30OSi/c1-6-7-8-9-10-11-12-15(14-5)13(2,3)4/h15H,6-12H2,1-5H3
InChIKeyJSJNJYNDDAXWCZ-UHFFFAOYSA-N
XLogP4.52
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.47
LogP ≤ 54.52
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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Related Compounds

heptadecyl(dimethoxy)silane
CID 173012112
dimethoxy(nonyl)silane
CID 154057580
docosyl(dimethoxy)silane
CID 150688039
butyl-tert-butyl-(1-methoxypropoxy)silane
CID 173316566
ethyl-hexyl-methoxysilane
CID 154130423
heptadecyl(dioctyl)silane
CID 173389450
2,2-dimethylpropane;heptane
CID 144531055
methoxymethane;undecane
CID 174775722
decane;ruthenium
CID 160818595
difluoro(undecyl)silane
CID 173381028
but-3-enyl-tert-butyl-methoxysilane
CID 154061638
diethoxy(tetracosyl)silane
CID 151502912

Frequently Asked Questions

What is the IUPAC name of tert-butyl-methoxy-octylsilane?
The IUPAC name of tert-butyl-methoxy-octylsilane (CID 154374497) is tert-butyl-methoxy-octylsilane.
What is the SMILES notation for tert-butyl-methoxy-octylsilane?
The canonical SMILES for tert-butyl-methoxy-octylsilane is CCCCCCCC[SiH](OC)C(C)(C)C.
What is the InChIKey of tert-butyl-methoxy-octylsilane?
The InChIKey is JSJNJYNDDAXWCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H30OSi/c1-6-7-8-9-10-11-12-15(14-5)13(2,3)4/h15H,6-12H2,1-5H3.
What are the key properties of tert-butyl-methoxy-octylsilane?
tert-butyl-methoxy-octylsilane has a molecular weight of 230.47 g/mol, XLogP of 4.52, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-methoxy-octylsilane is sourced from PubChem (CID 154374497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).