bis(trimethylsilyl) nonanedioate

C15H32O4Si2 — CID 519492

IUPACbis(trimethylsilyl) nonanedioate
SMILESC[Si](C)(C)OC(=O)CCCCCCCC(=O)O[Si](C)(C)C
InChIInChI=1S/C15H32O4Si2/c1-20(2,3)18-14(16)12-10-8-7-9-11-13-15(17)19-21(4,5)6/h7-13H2,1-6H3
InChIKeyUGESQDAUQLNVHU-UHFFFAOYSA-N
MW332.59 g/mol
LogP4.47
Rot. Bonds10

About bis(trimethylsilyl) nonanedioate

bis(trimethylsilyl) nonanedioate (PubChem CID 519492) has the molecular formula C15H32O4Si2 and a molecular weight of 332.59 g/mol. Its IUPAC name is bis(trimethylsilyl) nonanedioate.

Molecular Properties

Compound Namebis(trimethylsilyl) nonanedioate
PubChem CID519492
Molecular FormulaC15H32O4Si2
Molecular Weight332.59 g/mol
Exact Mass332.18
IUPAC Namebis(trimethylsilyl) nonanedioate
SMILESC[Si](C)(C)OC(=O)CCCCCCCC(=O)O[Si](C)(C)C
InChIInChI=1S/C15H32O4Si2/c1-20(2,3)18-14(16)12-10-8-7-9-11-13-15(17)19-21(4,5)6/h7-13H2,1-6H3
InChIKeyUGESQDAUQLNVHU-UHFFFAOYSA-N
XLogP4.47
TPSA52.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.59
LogP ≤ 54.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', '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) nonanedioate?
The IUPAC name of bis(trimethylsilyl) nonanedioate (CID 519492) is bis(trimethylsilyl) nonanedioate.
What is the SMILES notation for bis(trimethylsilyl) nonanedioate?
The canonical SMILES for bis(trimethylsilyl) nonanedioate is C[Si](C)(C)OC(=O)CCCCCCCC(=O)O[Si](C)(C)C.
What is the InChIKey of bis(trimethylsilyl) nonanedioate?
The InChIKey is UGESQDAUQLNVHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32O4Si2/c1-20(2,3)18-14(16)12-10-8-7-9-11-13-15(17)19-21(4,5)6/h7-13H2,1-6H3.
What are the key properties of bis(trimethylsilyl) nonanedioate?
bis(trimethylsilyl) nonanedioate has a molecular weight of 332.59 g/mol, XLogP of 4.47, 10 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for bis(trimethylsilyl) nonanedioate is sourced from PubChem (CID 519492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).