bis(trimethylsilyl) butanedioate

C10H22O4Si2 — CID 520988

IUPACbis(trimethylsilyl) butanedioate
SMILESC[Si](C)(C)OC(=O)CCC(=O)O[Si](C)(C)C
InChIInChI=1S/C10H22O4Si2/c1-15(2,3)13-9(11)7-8-10(12)14-16(4,5)6/h7-8H2,1-6H3
InChIKeyQUUDZINXVRFXLB-UHFFFAOYSA-N
MW262.45 g/mol
LogP2.52
Rot. Bonds5

About bis(trimethylsilyl) butanedioate

bis(trimethylsilyl) butanedioate (PubChem CID 520988) has the molecular formula C10H22O4Si2 and a molecular weight of 262.45 g/mol. Its IUPAC name is bis(trimethylsilyl) butanedioate.

Molecular Properties

Compound Namebis(trimethylsilyl) butanedioate
PubChem CID520988
Molecular FormulaC10H22O4Si2
Molecular Weight262.45 g/mol
Exact Mass262.11
IUPAC Namebis(trimethylsilyl) butanedioate
SMILESC[Si](C)(C)OC(=O)CCC(=O)O[Si](C)(C)C
InChIInChI=1S/C10H22O4Si2/c1-15(2,3)13-9(11)7-8-10(12)14-16(4,5)6/h7-8H2,1-6H3
InChIKeyQUUDZINXVRFXLB-UHFFFAOYSA-N
XLogP2.52
TPSA52.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.45
LogP ≤ 52.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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) butanedioate?
The IUPAC name of bis(trimethylsilyl) butanedioate (CID 520988) is bis(trimethylsilyl) butanedioate.
What is the SMILES notation for bis(trimethylsilyl) butanedioate?
The canonical SMILES for bis(trimethylsilyl) butanedioate is C[Si](C)(C)OC(=O)CCC(=O)O[Si](C)(C)C.
What is the InChIKey of bis(trimethylsilyl) butanedioate?
The InChIKey is QUUDZINXVRFXLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22O4Si2/c1-15(2,3)13-9(11)7-8-10(12)14-16(4,5)6/h7-8H2,1-6H3.
What are the key properties of bis(trimethylsilyl) butanedioate?
bis(trimethylsilyl) butanedioate has a molecular weight of 262.45 g/mol, XLogP of 2.52, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for bis(trimethylsilyl) butanedioate is sourced from PubChem (CID 520988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).