trimethylsilyl (E)-3-methyl-4-trimethylsilylbut-2-enoate

C11H24O2Si2 — CID 6508713

IUPACtrimethylsilyl (E)-3-methyl-4-trimethylsilylbut-2-enoate
SMILESC/C(=C\C(=O)O[Si](C)(C)C)C[Si](C)(C)C
InChIInChI=1S/C11H24O2Si2/c1-10(9-14(2,3)4)8-11(12)13-15(5,6)7/h8H,9H2,1-7H3/b10-8+
InChIKeyQCGGJRHSTCBUNL-CSKARUKUSA-N
MW244.48 g/mol
LogP3.65
Rot. Bonds4

About trimethylsilyl (E)-3-methyl-4-trimethylsilylbut-2-enoate

trimethylsilyl (E)-3-methyl-4-trimethylsilylbut-2-enoate (PubChem CID 6508713) has the molecular formula C11H24O2Si2 and a molecular weight of 244.48 g/mol. Its IUPAC name is trimethylsilyl (E)-3-methyl-4-trimethylsilylbut-2-enoate.

Molecular Properties

Compound Nametrimethylsilyl (E)-3-methyl-4-trimethylsilylbut-2-enoate
PubChem CID6508713
Molecular FormulaC11H24O2Si2
Molecular Weight244.48 g/mol
Exact Mass244.13
IUPAC Nametrimethylsilyl (E)-3-methyl-4-trimethylsilylbut-2-enoate
SMILESC/C(=C\C(=O)O[Si](C)(C)C)C[Si](C)(C)C
InChIInChI=1S/C11H24O2Si2/c1-10(9-14(2,3)4)8-11(12)13-15(5,6)7/h8H,9H2,1-7H3/b10-8+
InChIKeyQCGGJRHSTCBUNL-CSKARUKUSA-N
XLogP3.65
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.48
LogP ≤ 53.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of trimethylsilyl (E)-3-methyl-4-trimethylsilylbut-2-enoate?
The IUPAC name of trimethylsilyl (E)-3-methyl-4-trimethylsilylbut-2-enoate (CID 6508713) is trimethylsilyl (E)-3-methyl-4-trimethylsilylbut-2-enoate.
What is the SMILES notation for trimethylsilyl (E)-3-methyl-4-trimethylsilylbut-2-enoate?
The canonical SMILES for trimethylsilyl (E)-3-methyl-4-trimethylsilylbut-2-enoate is C/C(=C\C(=O)O[Si](C)(C)C)C[Si](C)(C)C.
What is the InChIKey of trimethylsilyl (E)-3-methyl-4-trimethylsilylbut-2-enoate?
The InChIKey is QCGGJRHSTCBUNL-CSKARUKUSA-N. The full InChI is InChI=1S/C11H24O2Si2/c1-10(9-14(2,3)4)8-11(12)13-15(5,6)7/h8H,9H2,1-7H3/b10-8+.
What are the key properties of trimethylsilyl (E)-3-methyl-4-trimethylsilylbut-2-enoate?
trimethylsilyl (E)-3-methyl-4-trimethylsilylbut-2-enoate has a molecular weight of 244.48 g/mol, XLogP of 3.65, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trimethylsilyl (E)-3-methyl-4-trimethylsilylbut-2-enoate is sourced from PubChem (CID 6508713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).