bis(trimethylsilyl) 3-methyl-3-trimethylsilyloxypentanedioate

C15H34O5Si3 — CID 521668

IUPACbis(trimethylsilyl) 3-methyl-3-trimethylsilyloxypentanedioate
SMILESCC(CC(=O)O[Si](C)(C)C)(CC(=O)O[Si](C)(C)C)O[Si](C)(C)C
InChIInChI=1S/C15H34O5Si3/c1-15(20-23(8,9)10,11-13(16)18-21(2,3)4)12-14(17)19-22(5,6)7/h11-12H2,1-10H3
InChIKeySWDDFRVEZJUJJD-UHFFFAOYSA-N
MW378.69 g/mol
LogP4.13
Rot. Bonds8

About bis(trimethylsilyl) 3-methyl-3-trimethylsilyloxypentanedioate

bis(trimethylsilyl) 3-methyl-3-trimethylsilyloxypentanedioate (PubChem CID 521668) has the molecular formula C15H34O5Si3 and a molecular weight of 378.69 g/mol. Its IUPAC name is bis(trimethylsilyl) 3-methyl-3-trimethylsilyloxypentanedioate.

Molecular Properties

Compound Namebis(trimethylsilyl) 3-methyl-3-trimethylsilyloxypentanedioate
PubChem CID521668
Molecular FormulaC15H34O5Si3
Molecular Weight378.69 g/mol
Exact Mass378.17
IUPAC Namebis(trimethylsilyl) 3-methyl-3-trimethylsilyloxypentanedioate
SMILESCC(CC(=O)O[Si](C)(C)C)(CC(=O)O[Si](C)(C)C)O[Si](C)(C)C
InChIInChI=1S/C15H34O5Si3/c1-15(20-23(8,9)10,11-13(16)18-21(2,3)4)12-14(17)19-22(5,6)7/h11-12H2,1-10H3
InChIKeySWDDFRVEZJUJJD-UHFFFAOYSA-N
XLogP4.13
TPSA61.83 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.69
LogP ≤ 54.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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 bis(trimethylsilyl) 3-methyl-3-trimethylsilyloxypentanedioate?
The IUPAC name of bis(trimethylsilyl) 3-methyl-3-trimethylsilyloxypentanedioate (CID 521668) is bis(trimethylsilyl) 3-methyl-3-trimethylsilyloxypentanedioate.
What is the SMILES notation for bis(trimethylsilyl) 3-methyl-3-trimethylsilyloxypentanedioate?
The canonical SMILES for bis(trimethylsilyl) 3-methyl-3-trimethylsilyloxypentanedioate is CC(CC(=O)O[Si](C)(C)C)(CC(=O)O[Si](C)(C)C)O[Si](C)(C)C.
What is the InChIKey of bis(trimethylsilyl) 3-methyl-3-trimethylsilyloxypentanedioate?
The InChIKey is SWDDFRVEZJUJJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H34O5Si3/c1-15(20-23(8,9)10,11-13(16)18-21(2,3)4)12-14(17)19-22(5,6)7/h11-12H2,1-10H3.
What are the key properties of bis(trimethylsilyl) 3-methyl-3-trimethylsilyloxypentanedioate?
bis(trimethylsilyl) 3-methyl-3-trimethylsilyloxypentanedioate has a molecular weight of 378.69 g/mol, XLogP of 4.13, 8 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for bis(trimethylsilyl) 3-methyl-3-trimethylsilyloxypentanedioate is sourced from PubChem (CID 521668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).