tert-butyl-(6-ethenoxyhexoxy)-dimethylsilane

C14H30O2Si — CID 71372427

IUPACtert-butyl-(6-ethenoxyhexoxy)-dimethylsilane
SMILESC=COCCCCCCO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C14H30O2Si/c1-7-15-12-10-8-9-11-13-16-17(5,6)14(2,3)4/h7H,1,8-13H2,2-6H3
InChIKeyFFEMLQNWNPPWKJ-UHFFFAOYSA-N
MW258.48 g/mol
LogP4.73
Rot. Bonds9

About tert-butyl-(6-ethenoxyhexoxy)-dimethylsilane

tert-butyl-(6-ethenoxyhexoxy)-dimethylsilane (PubChem CID 71372427) has the molecular formula C14H30O2Si and a molecular weight of 258.48 g/mol. Its IUPAC name is tert-butyl-(6-ethenoxyhexoxy)-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-(6-ethenoxyhexoxy)-dimethylsilane
PubChem CID71372427
Molecular FormulaC14H30O2Si
Molecular Weight258.48 g/mol
Exact Mass258.20
IUPAC Nametert-butyl-(6-ethenoxyhexoxy)-dimethylsilane
SMILESC=COCCCCCCO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C14H30O2Si/c1-7-15-12-10-8-9-11-13-16-17(5,6)14(2,3)4/h7H,1,8-13H2,2-6H3
InChIKeyFFEMLQNWNPPWKJ-UHFFFAOYSA-N
XLogP4.73
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.48
LogP ≤ 54.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'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-(6-ethenoxyhexoxy)-dimethylsilane?
The IUPAC name of tert-butyl-(6-ethenoxyhexoxy)-dimethylsilane (CID 71372427) is tert-butyl-(6-ethenoxyhexoxy)-dimethylsilane.
What is the SMILES notation for tert-butyl-(6-ethenoxyhexoxy)-dimethylsilane?
The canonical SMILES for tert-butyl-(6-ethenoxyhexoxy)-dimethylsilane is C=COCCCCCCO[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-(6-ethenoxyhexoxy)-dimethylsilane?
The InChIKey is FFEMLQNWNPPWKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30O2Si/c1-7-15-12-10-8-9-11-13-16-17(5,6)14(2,3)4/h7H,1,8-13H2,2-6H3.
What are the key properties of tert-butyl-(6-ethenoxyhexoxy)-dimethylsilane?
tert-butyl-(6-ethenoxyhexoxy)-dimethylsilane has a molecular weight of 258.48 g/mol, XLogP of 4.73, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-(6-ethenoxyhexoxy)-dimethylsilane is sourced from PubChem (CID 71372427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).