tert-butyl-dimethyl-octoxysilane

C14H32OSi — CID 6430219

IUPACtert-butyl-dimethyl-octoxysilane
SMILESCCCCCCCCO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C14H32OSi/c1-7-8-9-10-11-12-13-15-16(5,6)14(2,3)4/h7-13H2,1-6H3
InChIKeyUBGVJSRKDQAEKE-UHFFFAOYSA-N
MW244.49 g/mol
LogP5.37
Rot. Bonds8

About tert-butyl-dimethyl-octoxysilane

tert-butyl-dimethyl-octoxysilane (PubChem CID 6430219) has the molecular formula C14H32OSi and a molecular weight of 244.49 g/mol. Its IUPAC name is tert-butyl-dimethyl-octoxysilane.

Molecular Properties

Compound Nametert-butyl-dimethyl-octoxysilane
PubChem CID6430219
Molecular FormulaC14H32OSi
Molecular Weight244.49 g/mol
Exact Mass244.22
IUPAC Nametert-butyl-dimethyl-octoxysilane
SMILESCCCCCCCCO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C14H32OSi/c1-7-8-9-10-11-12-13-15-16(5,6)14(2,3)4/h7-13H2,1-6H3
InChIKeyUBGVJSRKDQAEKE-UHFFFAOYSA-N
XLogP5.37
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
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 tert-butyl-dimethyl-octoxysilane?
The IUPAC name of tert-butyl-dimethyl-octoxysilane (CID 6430219) is tert-butyl-dimethyl-octoxysilane.
What is the SMILES notation for tert-butyl-dimethyl-octoxysilane?
The canonical SMILES for tert-butyl-dimethyl-octoxysilane is CCCCCCCCO[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-dimethyl-octoxysilane?
The InChIKey is UBGVJSRKDQAEKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H32OSi/c1-7-8-9-10-11-12-13-15-16(5,6)14(2,3)4/h7-13H2,1-6H3.
What are the key properties of tert-butyl-dimethyl-octoxysilane?
tert-butyl-dimethyl-octoxysilane has a molecular weight of 244.49 g/mol, XLogP of 5.37, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-octoxysilane is sourced from PubChem (CID 6430219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).