bis(trimethylsilyl) 4-oxodecanedioate

C16H32O5Si2 — CID 91696403

IUPACbis(trimethylsilyl) 4-oxodecanedioate
SMILESC[Si](C)(C)OC(=O)CCCCCC(=O)CCC(=O)O[Si](C)(C)C
InChIInChI=1S/C16H32O5Si2/c1-22(2,3)20-15(18)11-9-7-8-10-14(17)12-13-16(19)21-23(4,5)6/h7-13H2,1-6H3
InChIKeyGOYHDBZUWQJPDW-UHFFFAOYSA-N
MW360.60 g/mol
LogP4.04
Rot. Bonds11

About bis(trimethylsilyl) 4-oxodecanedioate

bis(trimethylsilyl) 4-oxodecanedioate (PubChem CID 91696403) has the molecular formula C16H32O5Si2 and a molecular weight of 360.60 g/mol. Its IUPAC name is bis(trimethylsilyl) 4-oxodecanedioate.

Molecular Properties

Compound Namebis(trimethylsilyl) 4-oxodecanedioate
PubChem CID91696403
Molecular FormulaC16H32O5Si2
Molecular Weight360.60 g/mol
Exact Mass360.18
IUPAC Namebis(trimethylsilyl) 4-oxodecanedioate
SMILESC[Si](C)(C)OC(=O)CCCCCC(=O)CCC(=O)O[Si](C)(C)C
InChIInChI=1S/C16H32O5Si2/c1-22(2,3)20-15(18)11-9-7-8-10-14(17)12-13-16(19)21-23(4,5)6/h7-13H2,1-6H3
InChIKeyGOYHDBZUWQJPDW-UHFFFAOYSA-N
XLogP4.04
TPSA69.67 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds11
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.60
LogP ≤ 54.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

Trimethylsilyl stearate
CID 87777
Npc119807
CID 519592
Hexadecanic acid, trimethylsilyl ester
CID 521638
Trimethylsilyl tridecanoate
CID 519342
n-Pentanoic acid, trimethylsilyl ester
CID 523679
Bis(trimethylsilyl) sebacate
CID 519558
Octanedioic acid, bis(trimethylsilyl) ester
CID 521138
Trimethylsilyl tetracosanoate
CID 522540
Bis(trimethylsilyl) azelaate
CID 519492
Trimethylsilyl heptadecanoate
CID 521635
Arachidic acid, trimethylsilyl ester
CID 521648
Trimethylsilyl nonadecanoate
CID 522538

Frequently Asked Questions

What is the IUPAC name of bis(trimethylsilyl) 4-oxodecanedioate?
The IUPAC name of bis(trimethylsilyl) 4-oxodecanedioate (CID 91696403) is bis(trimethylsilyl) 4-oxodecanedioate.
What is the SMILES notation for bis(trimethylsilyl) 4-oxodecanedioate?
The canonical SMILES for bis(trimethylsilyl) 4-oxodecanedioate is C[Si](C)(C)OC(=O)CCCCCC(=O)CCC(=O)O[Si](C)(C)C.
What is the InChIKey of bis(trimethylsilyl) 4-oxodecanedioate?
The InChIKey is GOYHDBZUWQJPDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32O5Si2/c1-22(2,3)20-15(18)11-9-7-8-10-14(17)12-13-16(19)21-23(4,5)6/h7-13H2,1-6H3.
What are the key properties of bis(trimethylsilyl) 4-oxodecanedioate?
bis(trimethylsilyl) 4-oxodecanedioate has a molecular weight of 360.60 g/mol, XLogP of 4.04, 11 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for bis(trimethylsilyl) 4-oxodecanedioate is sourced from PubChem (CID 91696403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).