2-[2-[2-(3-trimethylsilylpropoxy)ethoxy]ethoxy]ethanol

C12H28O4Si — CID 542367

IUPAC2-[2-[2-(3-trimethylsilylpropoxy)ethoxy]ethoxy]ethanol
SMILESC[Si](C)(C)CCCOCCOCCOCCO
InChIInChI=1S/C12H28O4Si/c1-17(2,3)12-4-6-14-8-10-16-11-9-15-7-5-13/h13H,4-12H2,1-3H3
InChIKeyBXWXKLAQVIMROC-UHFFFAOYSA-N
MW264.44 g/mol
LogP1.76
Rot. Bonds12

About 2-[2-[2-(3-trimethylsilylpropoxy)ethoxy]ethoxy]ethanol

2-[2-[2-(3-trimethylsilylpropoxy)ethoxy]ethoxy]ethanol (PubChem CID 542367) has the molecular formula C12H28O4Si and a molecular weight of 264.44 g/mol. Its IUPAC name is 2-[2-[2-(3-trimethylsilylpropoxy)ethoxy]ethoxy]ethanol.

Molecular Properties

Compound Name2-[2-[2-(3-trimethylsilylpropoxy)ethoxy]ethoxy]ethanol
PubChem CID542367
Molecular FormulaC12H28O4Si
Molecular Weight264.44 g/mol
Exact Mass264.18
IUPAC Name2-[2-[2-(3-trimethylsilylpropoxy)ethoxy]ethoxy]ethanol
SMILESC[Si](C)(C)CCCOCCOCCOCCO
InChIInChI=1S/C12H28O4Si/c1-17(2,3)12-4-6-14-8-10-16-11-9-15-7-5-13/h13H,4-12H2,1-3H3
InChIKeyBXWXKLAQVIMROC-UHFFFAOYSA-N
XLogP1.76
TPSA47.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds12
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.44
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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 2-[2-[2-(3-trimethylsilylpropoxy)ethoxy]ethoxy]ethanol?
The IUPAC name of 2-[2-[2-(3-trimethylsilylpropoxy)ethoxy]ethoxy]ethanol (CID 542367) is 2-[2-[2-(3-trimethylsilylpropoxy)ethoxy]ethoxy]ethanol.
What is the SMILES notation for 2-[2-[2-(3-trimethylsilylpropoxy)ethoxy]ethoxy]ethanol?
The canonical SMILES for 2-[2-[2-(3-trimethylsilylpropoxy)ethoxy]ethoxy]ethanol is C[Si](C)(C)CCCOCCOCCOCCO.
What is the InChIKey of 2-[2-[2-(3-trimethylsilylpropoxy)ethoxy]ethoxy]ethanol?
The InChIKey is BXWXKLAQVIMROC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H28O4Si/c1-17(2,3)12-4-6-14-8-10-16-11-9-15-7-5-13/h13H,4-12H2,1-3H3.
What are the key properties of 2-[2-[2-(3-trimethylsilylpropoxy)ethoxy]ethoxy]ethanol?
2-[2-[2-(3-trimethylsilylpropoxy)ethoxy]ethoxy]ethanol has a molecular weight of 264.44 g/mol, XLogP of 1.76, 12 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[2-(3-trimethylsilylpropoxy)ethoxy]ethoxy]ethanol is sourced from PubChem (CID 542367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).