bis(trimethylsilyl) 2-methylpropanedioate

C10H22O4Si2 — CID 520992

IUPACbis(trimethylsilyl) 2-methylpropanedioate
SMILESCC(C(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C
InChIInChI=1S/C10H22O4Si2/c1-8(9(11)13-15(2,3)4)10(12)14-16(5,6)7/h8H,1-7H3
InChIKeyLJDAAXOEMCESSS-UHFFFAOYSA-N
MW262.45 g/mol
LogP2.38
Rot. Bonds4

About bis(trimethylsilyl) 2-methylpropanedioate

bis(trimethylsilyl) 2-methylpropanedioate (PubChem CID 520992) has the molecular formula C10H22O4Si2 and a molecular weight of 262.45 g/mol. Its IUPAC name is bis(trimethylsilyl) 2-methylpropanedioate.

Molecular Properties

Compound Namebis(trimethylsilyl) 2-methylpropanedioate
PubChem CID520992
Molecular FormulaC10H22O4Si2
Molecular Weight262.45 g/mol
Exact Mass262.11
IUPAC Namebis(trimethylsilyl) 2-methylpropanedioate
SMILESCC(C(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C
InChIInChI=1S/C10H22O4Si2/c1-8(9(11)13-15(2,3)4)10(12)14-16(5,6)7/h8H,1-7H3
InChIKeyLJDAAXOEMCESSS-UHFFFAOYSA-N
XLogP2.38
TPSA52.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.45
LogP ≤ 52.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of bis(trimethylsilyl) 2-methylpropanedioate?
The IUPAC name of bis(trimethylsilyl) 2-methylpropanedioate (CID 520992) is bis(trimethylsilyl) 2-methylpropanedioate.
What is the SMILES notation for bis(trimethylsilyl) 2-methylpropanedioate?
The canonical SMILES for bis(trimethylsilyl) 2-methylpropanedioate is CC(C(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C.
What is the InChIKey of bis(trimethylsilyl) 2-methylpropanedioate?
The InChIKey is LJDAAXOEMCESSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22O4Si2/c1-8(9(11)13-15(2,3)4)10(12)14-16(5,6)7/h8H,1-7H3.
What are the key properties of bis(trimethylsilyl) 2-methylpropanedioate?
bis(trimethylsilyl) 2-methylpropanedioate has a molecular weight of 262.45 g/mol, XLogP of 2.38, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for bis(trimethylsilyl) 2-methylpropanedioate is sourced from PubChem (CID 520992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).