[tert-butyl(dimethyl)silyl] 2-[tert-butyl(dimethyl)silyl]oxypropanoate

C15H34O3Si2 — CID 528563

IUPAC[tert-butyl(dimethyl)silyl] 2-[tert-butyl(dimethyl)silyl]oxypropanoate
SMILESCC(O[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C15H34O3Si2/c1-12(17-19(8,9)14(2,3)4)13(16)18-20(10,11)15(5,6)7/h12H,1-11H3
InChIKeyYZJJQQKVFWRPJH-UHFFFAOYSA-N
MW318.61 g/mol
LogP4.95
Rot. Bonds4

About [tert-butyl(dimethyl)silyl] 2-[tert-butyl(dimethyl)silyl]oxypropanoate

[tert-butyl(dimethyl)silyl] 2-[tert-butyl(dimethyl)silyl]oxypropanoate (PubChem CID 528563) has the molecular formula C15H34O3Si2 and a molecular weight of 318.61 g/mol. Its IUPAC name is [tert-butyl(dimethyl)silyl] 2-[tert-butyl(dimethyl)silyl]oxypropanoate.

Molecular Properties

Compound Name[tert-butyl(dimethyl)silyl] 2-[tert-butyl(dimethyl)silyl]oxypropanoate
PubChem CID528563
Molecular FormulaC15H34O3Si2
Molecular Weight318.61 g/mol
Exact Mass318.20
IUPAC Name[tert-butyl(dimethyl)silyl] 2-[tert-butyl(dimethyl)silyl]oxypropanoate
SMILESCC(O[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C15H34O3Si2/c1-12(17-19(8,9)14(2,3)4)13(16)18-20(10,11)15(5,6)7/h12H,1-11H3
InChIKeyYZJJQQKVFWRPJH-UHFFFAOYSA-N
XLogP4.95
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.61
LogP ≤ 54.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [tert-butyl(dimethyl)silyl] 2-[tert-butyl(dimethyl)silyl]oxypropanoate?
The IUPAC name of [tert-butyl(dimethyl)silyl] 2-[tert-butyl(dimethyl)silyl]oxypropanoate (CID 528563) is [tert-butyl(dimethyl)silyl] 2-[tert-butyl(dimethyl)silyl]oxypropanoate.
What is the SMILES notation for [tert-butyl(dimethyl)silyl] 2-[tert-butyl(dimethyl)silyl]oxypropanoate?
The canonical SMILES for [tert-butyl(dimethyl)silyl] 2-[tert-butyl(dimethyl)silyl]oxypropanoate is CC(O[Si](C)(C)C(C)(C)C)C(=O)O[Si](C)(C)C(C)(C)C.
What is the InChIKey of [tert-butyl(dimethyl)silyl] 2-[tert-butyl(dimethyl)silyl]oxypropanoate?
The InChIKey is YZJJQQKVFWRPJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H34O3Si2/c1-12(17-19(8,9)14(2,3)4)13(16)18-20(10,11)15(5,6)7/h12H,1-11H3.
What are the key properties of [tert-butyl(dimethyl)silyl] 2-[tert-butyl(dimethyl)silyl]oxypropanoate?
[tert-butyl(dimethyl)silyl] 2-[tert-butyl(dimethyl)silyl]oxypropanoate has a molecular weight of 318.61 g/mol, XLogP of 4.95, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [tert-butyl(dimethyl)silyl] 2-[tert-butyl(dimethyl)silyl]oxypropanoate is sourced from PubChem (CID 528563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).