tert-butyl-dimethyl-(4-methylnonan-4-yloxy)silane

C16H36OSi — CID 140734282

IUPACtert-butyl-dimethyl-(4-methylnonan-4-yloxy)silane
SMILESCCCCCC(C)(CCC)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C16H36OSi/c1-9-11-12-14-16(6,13-10-2)17-18(7,8)15(3,4)5/h9-14H2,1-8H3
InChIKeyZJSHERFOUAENBF-UHFFFAOYSA-N
MW272.55 g/mol
LogP6.15
Rot. Bonds8

About tert-butyl-dimethyl-(4-methylnonan-4-yloxy)silane

tert-butyl-dimethyl-(4-methylnonan-4-yloxy)silane (PubChem CID 140734282) has the molecular formula C16H36OSi and a molecular weight of 272.55 g/mol. Its IUPAC name is tert-butyl-dimethyl-(4-methylnonan-4-yloxy)silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-(4-methylnonan-4-yloxy)silane
PubChem CID140734282
Molecular FormulaC16H36OSi
Molecular Weight272.55 g/mol
Exact Mass272.25
IUPAC Nametert-butyl-dimethyl-(4-methylnonan-4-yloxy)silane
SMILESCCCCCC(C)(CCC)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C16H36OSi/c1-9-11-12-14-16(6,13-10-2)17-18(7,8)15(3,4)5/h9-14H2,1-8H3
InChIKeyZJSHERFOUAENBF-UHFFFAOYSA-N
XLogP6.15
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500272.55
LogP ≤ 56.15
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 tert-butyl-dimethyl-(4-methylnonan-4-yloxy)silane?
The IUPAC name of tert-butyl-dimethyl-(4-methylnonan-4-yloxy)silane (CID 140734282) is tert-butyl-dimethyl-(4-methylnonan-4-yloxy)silane.
What is the SMILES notation for tert-butyl-dimethyl-(4-methylnonan-4-yloxy)silane?
The canonical SMILES for tert-butyl-dimethyl-(4-methylnonan-4-yloxy)silane is CCCCCC(C)(CCC)O[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-dimethyl-(4-methylnonan-4-yloxy)silane?
The InChIKey is ZJSHERFOUAENBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H36OSi/c1-9-11-12-14-16(6,13-10-2)17-18(7,8)15(3,4)5/h9-14H2,1-8H3.
What are the key properties of tert-butyl-dimethyl-(4-methylnonan-4-yloxy)silane?
tert-butyl-dimethyl-(4-methylnonan-4-yloxy)silane has a molecular weight of 272.55 g/mol, XLogP of 6.15, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-(4-methylnonan-4-yloxy)silane is sourced from PubChem (CID 140734282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).