[tert-butyl(dimethyl)silyl] 2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]acetate

C19H40O8Si — CID 91694129

IUPAC[tert-butyl(dimethyl)silyl] 2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]acetate
SMILESCOCCOCCOCCOCCOCCOCC(=O)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C19H40O8Si/c1-19(2,3)28(5,6)27-18(20)17-26-16-15-25-14-13-24-12-11-23-10-9-22-8-7-21-4/h7-17H2,1-6H3
InChIKeyACABWDLMPWIRCO-UHFFFAOYSA-N
MW424.61 g/mol
LogP2.26
Rot. Bonds18

About [tert-butyl(dimethyl)silyl] 2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]acetate

[tert-butyl(dimethyl)silyl] 2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]acetate (PubChem CID 91694129) has the molecular formula C19H40O8Si and a molecular weight of 424.61 g/mol. Its IUPAC name is [tert-butyl(dimethyl)silyl] 2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]acetate.

Molecular Properties

Compound Name[tert-butyl(dimethyl)silyl] 2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]acetate
PubChem CID91694129
Molecular FormulaC19H40O8Si
Molecular Weight424.61 g/mol
Exact Mass424.25
IUPAC Name[tert-butyl(dimethyl)silyl] 2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]acetate
SMILESCOCCOCCOCCOCCOCCOCC(=O)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C19H40O8Si/c1-19(2,3)28(5,6)27-18(20)17-26-16-15-25-14-13-24-12-11-23-10-9-22-8-7-21-4/h7-17H2,1-6H3
InChIKeyACABWDLMPWIRCO-UHFFFAOYSA-N
XLogP2.26
TPSA81.68 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds18
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500424.61
LogP ≤ 52.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

[tert-butyl(dimethyl)silyl] 2-[2-(2-methoxyethoxy)ethoxy]acetate
CID 91694127
[tert-butyl(dimethyl)silyl] 2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]acetate
CID 91694132
trimethylsilyl 2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]acetate
CID 91694090
tert-butyl 2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]acetate
CID 155606966
tert-butyl-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-dimethylsilane
CID 91694118
methyl 2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]acetate
CID 91694163
4-O-[tert-butyl(dimethyl)silyl] 1-O-methyl butanedioate
CID 87697847
2-[2-[2-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]ethoxy]acetic acid
CID 170898180
bis[tert-butyl(dimethyl)silyl] hexanedioate
CID 528567
1-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-3,3-dimethylbutan-2-one
CID 113427120
[tert-butyl(dimethyl)silyl] 2-chloroacetate
CID 4279826
2-O-[tert-butyl(dimethyl)silyl] 1-O-[2-(2-methoxyethoxy)ethyl] benzene-1,2-dicarboxylate
CID 91694142

Frequently Asked Questions

What is the IUPAC name of [tert-butyl(dimethyl)silyl] 2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]acetate?
The IUPAC name of [tert-butyl(dimethyl)silyl] 2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]acetate (CID 91694129) is [tert-butyl(dimethyl)silyl] 2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]acetate.
What is the SMILES notation for [tert-butyl(dimethyl)silyl] 2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]acetate?
The canonical SMILES for [tert-butyl(dimethyl)silyl] 2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]acetate is COCCOCCOCCOCCOCCOCC(=O)O[Si](C)(C)C(C)(C)C.
What is the InChIKey of [tert-butyl(dimethyl)silyl] 2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]acetate?
The InChIKey is ACABWDLMPWIRCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H40O8Si/c1-19(2,3)28(5,6)27-18(20)17-26-16-15-25-14-13-24-12-11-23-10-9-22-8-7-21-4/h7-17H2,1-6H3.
What are the key properties of [tert-butyl(dimethyl)silyl] 2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]acetate?
[tert-butyl(dimethyl)silyl] 2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]acetate has a molecular weight of 424.61 g/mol, XLogP of 2.26, 18 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for [tert-butyl(dimethyl)silyl] 2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]acetate is sourced from PubChem (CID 91694129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).