bis(trimethylsilyl) 2-methylidenebutanedioate

C11H22O4Si2 — CID 521622

IUPACbis(trimethylsilyl) 2-methylidenebutanedioate
SMILESC=C(CC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C
InChIInChI=1S/C11H22O4Si2/c1-9(11(13)15-17(5,6)7)8-10(12)14-16(2,3)4/h1,8H2,2-7H3
InChIKeyIYEWOPPVIQNFQO-UHFFFAOYSA-N
MW274.46 g/mol
LogP2.69
Rot. Bonds5

About bis(trimethylsilyl) 2-methylidenebutanedioate

bis(trimethylsilyl) 2-methylidenebutanedioate (PubChem CID 521622) has the molecular formula C11H22O4Si2 and a molecular weight of 274.46 g/mol. Its IUPAC name is bis(trimethylsilyl) 2-methylidenebutanedioate.

Molecular Properties

Compound Namebis(trimethylsilyl) 2-methylidenebutanedioate
PubChem CID521622
Molecular FormulaC11H22O4Si2
Molecular Weight274.46 g/mol
Exact Mass274.11
IUPAC Namebis(trimethylsilyl) 2-methylidenebutanedioate
SMILESC=C(CC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C
InChIInChI=1S/C11H22O4Si2/c1-9(11(13)15-17(5,6)7)8-10(12)14-16(2,3)4/h1,8H2,2-7H3
InChIKeyIYEWOPPVIQNFQO-UHFFFAOYSA-N
XLogP2.69
TPSA52.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.46
LogP ≤ 52.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Analyze bis(trimethylsilyl) 2-methylidenebutanedioate 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

Aconitic acid, TMS
CID 5366595
1-Propene-1,2,3-tricarboxylic acid, tris(trimethylsilyl) ester, (E)-
CID 5352948
Itaconic acid, TBDMS
CID 6428869
1,2,3-Tris(trimethylsilyl) 1-propene-1,2,3-tricarboxylate
CID 521697
t-Butyldimethylsilyl 4-((t-butyldimethylsilyl)oxy)-2-methylenebutanoate
CID 134817949
4-O-methyl 1-O-tri(propan-2-yl)silyl 2-methylidenebutanedioate
CID 17848411
1-O-[ethyl(dimethyl)silyl] 4-O-methyl 2-methylidenebutanedioate
CID 19063301
1-O-[butyl(dimethyl)silyl] 4-O-methyl 2-methylidenebutanedioate
CID 19063309
4-O-ethyl 1-O-triethylsilyl 2-methylidenebutanedioate
CID 19063312
4-O-methyl 1-O-[tris(2-methylpropyl)silyl] 2-methylidenebutanedioate
CID 19063330
4-O-methyl 1-O-tritert-butylsilyl 2-methylidenebutanedioate
CID 19063342
3-Methylidene-2,2-bis(trimethylsilyl)butanedioic acid
CID 21923871

Frequently Asked Questions

What is the IUPAC name of bis(trimethylsilyl) 2-methylidenebutanedioate?
The IUPAC name of bis(trimethylsilyl) 2-methylidenebutanedioate (CID 521622) is bis(trimethylsilyl) 2-methylidenebutanedioate.
What is the SMILES notation for bis(trimethylsilyl) 2-methylidenebutanedioate?
The canonical SMILES for bis(trimethylsilyl) 2-methylidenebutanedioate is C=C(CC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C.
What is the InChIKey of bis(trimethylsilyl) 2-methylidenebutanedioate?
The InChIKey is IYEWOPPVIQNFQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22O4Si2/c1-9(11(13)15-17(5,6)7)8-10(12)14-16(2,3)4/h1,8H2,2-7H3.
What are the key properties of bis(trimethylsilyl) 2-methylidenebutanedioate?
bis(trimethylsilyl) 2-methylidenebutanedioate has a molecular weight of 274.46 g/mol, XLogP of 2.69, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for bis(trimethylsilyl) 2-methylidenebutanedioate is sourced from PubChem (CID 521622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).