tert-butyl-ethoxy-methoxy-pentylsilane

C12H28O2Si — CID 18990704

IUPACtert-butyl-ethoxy-methoxy-pentylsilane
SMILESCCCCC[Si](OC)(OCC)C(C)(C)C
InChIInChI=1S/C12H28O2Si/c1-7-9-10-11-15(13-6,14-8-2)12(3,4)5/h7-11H2,1-6H3
InChIKeyYZADKZBYHPGSCE-UHFFFAOYSA-N
MW232.44 g/mol
LogP4.10
Rot. Bonds7

About tert-butyl-ethoxy-methoxy-pentylsilane

tert-butyl-ethoxy-methoxy-pentylsilane (PubChem CID 18990704) has the molecular formula C12H28O2Si and a molecular weight of 232.44 g/mol. Its IUPAC name is tert-butyl-ethoxy-methoxy-pentylsilane.

Molecular Properties

Compound Nametert-butyl-ethoxy-methoxy-pentylsilane
PubChem CID18990704
Molecular FormulaC12H28O2Si
Molecular Weight232.44 g/mol
Exact Mass232.19
IUPAC Nametert-butyl-ethoxy-methoxy-pentylsilane
SMILESCCCCC[Si](OC)(OCC)C(C)(C)C
InChIInChI=1S/C12H28O2Si/c1-7-9-10-11-15(13-6,14-8-2)12(3,4)5/h7-11H2,1-6H3
InChIKeyYZADKZBYHPGSCE-UHFFFAOYSA-N
XLogP4.10
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.44
LogP ≤ 54.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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-ethoxy-methoxy-pentylsilane?
The IUPAC name of tert-butyl-ethoxy-methoxy-pentylsilane (CID 18990704) is tert-butyl-ethoxy-methoxy-pentylsilane.
What is the SMILES notation for tert-butyl-ethoxy-methoxy-pentylsilane?
The canonical SMILES for tert-butyl-ethoxy-methoxy-pentylsilane is CCCCC[Si](OC)(OCC)C(C)(C)C.
What is the InChIKey of tert-butyl-ethoxy-methoxy-pentylsilane?
The InChIKey is YZADKZBYHPGSCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H28O2Si/c1-7-9-10-11-15(13-6,14-8-2)12(3,4)5/h7-11H2,1-6H3.
What are the key properties of tert-butyl-ethoxy-methoxy-pentylsilane?
tert-butyl-ethoxy-methoxy-pentylsilane has a molecular weight of 232.44 g/mol, XLogP of 4.10, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-ethoxy-methoxy-pentylsilane is sourced from PubChem (CID 18990704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).