bis(trimethylsilyl) 2-methylbutanedioate

C11H24O4Si2 — CID 521658

IUPACbis(trimethylsilyl) 2-methylbutanedioate
SMILESCC(CC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C
InChIInChI=1S/C11H24O4Si2/c1-9(11(13)15-17(5,6)7)8-10(12)14-16(2,3)4/h9H,8H2,1-7H3
InChIKeyOAMWTEBQZKRCMA-UHFFFAOYSA-N
MW276.48 g/mol
LogP2.77
Rot. Bonds5

About bis(trimethylsilyl) 2-methylbutanedioate

bis(trimethylsilyl) 2-methylbutanedioate (PubChem CID 521658) has the molecular formula C11H24O4Si2 and a molecular weight of 276.48 g/mol. Its IUPAC name is bis(trimethylsilyl) 2-methylbutanedioate.

Molecular Properties

Compound Namebis(trimethylsilyl) 2-methylbutanedioate
PubChem CID521658
Molecular FormulaC11H24O4Si2
Molecular Weight276.48 g/mol
Exact Mass276.12
IUPAC Namebis(trimethylsilyl) 2-methylbutanedioate
SMILESCC(CC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C
InChIInChI=1S/C11H24O4Si2/c1-9(11(13)15-17(5,6)7)8-10(12)14-16(2,3)4/h9H,8H2,1-7H3
InChIKeyOAMWTEBQZKRCMA-UHFFFAOYSA-N
XLogP2.77
TPSA52.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.48
LogP ≤ 52.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze bis(trimethylsilyl) 2-methylbutanedioate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Butanoic acid, 3-methyl-, trimethylsilyl ester
CID 187882
Bis(trimethylsilyl) succinate
CID 520988
Trimethylsilyl 2-methylbutanoate
CID 521654
Bis(dimethyl-t-butylsilyl) succinate
CID 528596
Butanedioic acid, 2,2-dimethyl-, bis(trimethylsilyl) ester
CID 521644
Butanedioic acid, 2,3-dimethyl-, bis(trimethylsilyl) ester
CID 521659
3-Methyl-4-trimethylsiloxy(trimethylsilyl)butyrate
CID 523685
Bis[tert-butyl(dimethyl)silyl] 2-methylsuccinate
CID 528584
2H4-Succinic acid (2tms)
CID 91749919
2,2-Dimethylsuccinic acid, TBDMS
CID 91752559
Trimethylsilyl 2,3-dimethyl-4-trimethylsilyloxybutyrate
CID 553085
1,1,2-Propanetricarboxylic acid, tris(trimethylsilyl) ester
CID 553637

Frequently Asked Questions

What is the IUPAC name of bis(trimethylsilyl) 2-methylbutanedioate?
The IUPAC name of bis(trimethylsilyl) 2-methylbutanedioate (CID 521658) is bis(trimethylsilyl) 2-methylbutanedioate.
What is the SMILES notation for bis(trimethylsilyl) 2-methylbutanedioate?
The canonical SMILES for bis(trimethylsilyl) 2-methylbutanedioate is CC(CC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C.
What is the InChIKey of bis(trimethylsilyl) 2-methylbutanedioate?
The InChIKey is OAMWTEBQZKRCMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24O4Si2/c1-9(11(13)15-17(5,6)7)8-10(12)14-16(2,3)4/h9H,8H2,1-7H3.
What are the key properties of bis(trimethylsilyl) 2-methylbutanedioate?
bis(trimethylsilyl) 2-methylbutanedioate has a molecular weight of 276.48 g/mol, XLogP of 2.77, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for bis(trimethylsilyl) 2-methylbutanedioate is sourced from PubChem (CID 521658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).