ethyl 2-[2-[2-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]ethoxy]propanoate

C17H36O6Si — CID 140844510

IUPACethyl 2-[2-[2-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]ethoxy]propanoate
SMILESCCOC(=O)C(C)OCCOCCOCCO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C17H36O6Si/c1-8-21-16(18)15(2)22-13-11-19-9-10-20-12-14-23-24(6,7)17(3,4)5/h15H,8-14H2,1-7H3
InChIKeyIYGAJZQUWXNUOU-UHFFFAOYSA-N
MW364.56 g/mol
LogP3.01
Rot. Bonds13

About ethyl 2-[2-[2-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]ethoxy]propanoate

ethyl 2-[2-[2-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]ethoxy]propanoate (PubChem CID 140844510) has the molecular formula C17H36O6Si and a molecular weight of 364.56 g/mol. Its IUPAC name is ethyl 2-[2-[2-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]ethoxy]propanoate.

Molecular Properties

Compound Nameethyl 2-[2-[2-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]ethoxy]propanoate
PubChem CID140844510
Molecular FormulaC17H36O6Si
Molecular Weight364.56 g/mol
Exact Mass364.23
IUPAC Nameethyl 2-[2-[2-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]ethoxy]propanoate
SMILESCCOC(=O)C(C)OCCOCCOCCO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C17H36O6Si/c1-8-21-16(18)15(2)22-13-11-19-9-10-20-12-14-23-24(6,7)17(3,4)5/h15H,8-14H2,1-7H3
InChIKeyIYGAJZQUWXNUOU-UHFFFAOYSA-N
XLogP3.01
TPSA63.22 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds13
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.56
LogP ≤ 53.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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 ethyl 2-[2-[2-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]ethoxy]propanoate?
The IUPAC name of ethyl 2-[2-[2-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]ethoxy]propanoate (CID 140844510) is ethyl 2-[2-[2-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]ethoxy]propanoate.
What is the SMILES notation for ethyl 2-[2-[2-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]ethoxy]propanoate?
The canonical SMILES for ethyl 2-[2-[2-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]ethoxy]propanoate is CCOC(=O)C(C)OCCOCCOCCO[Si](C)(C)C(C)(C)C.
What is the InChIKey of ethyl 2-[2-[2-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]ethoxy]propanoate?
The InChIKey is IYGAJZQUWXNUOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H36O6Si/c1-8-21-16(18)15(2)22-13-11-19-9-10-20-12-14-23-24(6,7)17(3,4)5/h15H,8-14H2,1-7H3.
What are the key properties of ethyl 2-[2-[2-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]ethoxy]propanoate?
ethyl 2-[2-[2-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]ethoxy]propanoate has a molecular weight of 364.56 g/mol, XLogP of 3.01, 13 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-[2-[2-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]ethoxy]propanoate is sourced from PubChem (CID 140844510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).