bis(trimethylsilyl) 2-methyl-2-trimethylsilyloxypropanedioate

C13H30O5Si3 — CID 523395

IUPACbis(trimethylsilyl) 2-methyl-2-trimethylsilyloxypropanedioate
SMILESCC(O[Si](C)(C)C)(C(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C
InChIInChI=1S/C13H30O5Si3/c1-13(18-21(8,9)10,11(14)16-19(2,3)4)12(15)17-20(5,6)7/h1-10H3
InChIKeyJGZMZMIPCIWFLE-UHFFFAOYSA-N
MW350.64 g/mol
LogP3.35
Rot. Bonds6

About bis(trimethylsilyl) 2-methyl-2-trimethylsilyloxypropanedioate

bis(trimethylsilyl) 2-methyl-2-trimethylsilyloxypropanedioate (PubChem CID 523395) has the molecular formula C13H30O5Si3 and a molecular weight of 350.64 g/mol. Its IUPAC name is bis(trimethylsilyl) 2-methyl-2-trimethylsilyloxypropanedioate.

Molecular Properties

Compound Namebis(trimethylsilyl) 2-methyl-2-trimethylsilyloxypropanedioate
PubChem CID523395
Molecular FormulaC13H30O5Si3
Molecular Weight350.64 g/mol
Exact Mass350.14
IUPAC Namebis(trimethylsilyl) 2-methyl-2-trimethylsilyloxypropanedioate
SMILESCC(O[Si](C)(C)C)(C(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C
InChIInChI=1S/C13H30O5Si3/c1-13(18-21(8,9)10,11(14)16-19(2,3)4)12(15)17-20(5,6)7/h1-10H3
InChIKeyJGZMZMIPCIWFLE-UHFFFAOYSA-N
XLogP3.35
TPSA61.83 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.64
LogP ≤ 53.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

Propanoic acid, 2-methyl-2-[(trimethylsilyl)oxy]-, trimethylsilyl ester
CID 521575
Trimethylsilyl 2-methyl-2,3-bis[(trimethylsilyl)oxy]propanoate
CID 553502
Bis(trimethylsilyl) 2-[(trimethylsilyl)oxy]malonate
CID 520885
Glyceric acid tris-TMS
CID 520886
Ketomalonic acid, TMS
CID 23324411
C-Ethylglyceraric acid, TMS
CID 523392
C-(Hydroxymethyl)glyceraric acid, TMS
CID 523393
Propanedioic acid, (trimethylsilyl)[(trimethylsilyl)oxy]-, bis(trimethylsilyl) ester
CID 553155
Propanedioic acid, bis[(trimethylsilyl)oxy]-, bis(trimethylsilyl) ester
CID 553797
trimethylsilyl (2S)-2,3-bis(trimethylsilyloxy)propanoate
CID 101586801
trimethylsilyl (2R)-2,3-bis(trimethylsilyloxy)propanoate
CID 101586800

Frequently Asked Questions

What is the IUPAC name of bis(trimethylsilyl) 2-methyl-2-trimethylsilyloxypropanedioate?
The IUPAC name of bis(trimethylsilyl) 2-methyl-2-trimethylsilyloxypropanedioate (CID 523395) is bis(trimethylsilyl) 2-methyl-2-trimethylsilyloxypropanedioate.
What is the SMILES notation for bis(trimethylsilyl) 2-methyl-2-trimethylsilyloxypropanedioate?
The canonical SMILES for bis(trimethylsilyl) 2-methyl-2-trimethylsilyloxypropanedioate is CC(O[Si](C)(C)C)(C(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C.
What is the InChIKey of bis(trimethylsilyl) 2-methyl-2-trimethylsilyloxypropanedioate?
The InChIKey is JGZMZMIPCIWFLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H30O5Si3/c1-13(18-21(8,9)10,11(14)16-19(2,3)4)12(15)17-20(5,6)7/h1-10H3.
What are the key properties of bis(trimethylsilyl) 2-methyl-2-trimethylsilyloxypropanedioate?
bis(trimethylsilyl) 2-methyl-2-trimethylsilyloxypropanedioate has a molecular weight of 350.64 g/mol, XLogP of 3.35, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for bis(trimethylsilyl) 2-methyl-2-trimethylsilyloxypropanedioate is sourced from PubChem (CID 523395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).