lithium 1-[(2-methylpropan-2-yl)oxy]-2,2-bis(trimethylsilyl)ethenolate

C12H27LiO2Si2 — CID 23707917

IUPAClithium 1-[(2-methylpropan-2-yl)oxy]-2,2-bis(trimethylsilyl)ethenolate
SMILESCC(C)(C)OC([O-])=C([Si](C)(C)C)[Si](C)(C)C.[Li+]
InChIInChI=1S/C12H28O2Si2.Li/c1-12(2,3)14-10(13)11(15(4,5)6)16(7,8)9;/h13H,1-9H3;/q;+1/p-1
InChIKeyYTFDDCMFLYIWES-UHFFFAOYSA-M
MW266.46 g/mol
LogP0.13
Rot. Bonds3

About lithium 1-[(2-methylpropan-2-yl)oxy]-2,2-bis(trimethylsilyl)ethenolate

lithium 1-[(2-methylpropan-2-yl)oxy]-2,2-bis(trimethylsilyl)ethenolate (PubChem CID 23707917) has the molecular formula C12H27LiO2Si2 and a molecular weight of 266.46 g/mol. Its IUPAC name is lithium 1-[(2-methylpropan-2-yl)oxy]-2,2-bis(trimethylsilyl)ethenolate.

Molecular Properties

Compound Namelithium 1-[(2-methylpropan-2-yl)oxy]-2,2-bis(trimethylsilyl)ethenolate
PubChem CID23707917
Molecular FormulaC12H27LiO2Si2
Molecular Weight266.46 g/mol
Exact Mass266.17
IUPAC Namelithium 1-[(2-methylpropan-2-yl)oxy]-2,2-bis(trimethylsilyl)ethenolate
SMILESCC(C)(C)OC([O-])=C([Si](C)(C)C)[Si](C)(C)C.[Li+]
InChIInChI=1S/C12H28O2Si2.Li/c1-12(2,3)14-10(13)11(15(4,5)6)16(7,8)9;/h13H,1-9H3;/q;+1/p-1
InChIKeyYTFDDCMFLYIWES-UHFFFAOYSA-M
XLogP0.13
TPSA32.29 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.46
LogP ≤ 50.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of lithium 1-[(2-methylpropan-2-yl)oxy]-2,2-bis(trimethylsilyl)ethenolate?
The IUPAC name of lithium 1-[(2-methylpropan-2-yl)oxy]-2,2-bis(trimethylsilyl)ethenolate (CID 23707917) is lithium 1-[(2-methylpropan-2-yl)oxy]-2,2-bis(trimethylsilyl)ethenolate.
What is the SMILES notation for lithium 1-[(2-methylpropan-2-yl)oxy]-2,2-bis(trimethylsilyl)ethenolate?
The canonical SMILES for lithium 1-[(2-methylpropan-2-yl)oxy]-2,2-bis(trimethylsilyl)ethenolate is CC(C)(C)OC([O-])=C([Si](C)(C)C)[Si](C)(C)C.[Li+].
What is the InChIKey of lithium 1-[(2-methylpropan-2-yl)oxy]-2,2-bis(trimethylsilyl)ethenolate?
The InChIKey is YTFDDCMFLYIWES-UHFFFAOYSA-M. The full InChI is InChI=1S/C12H28O2Si2.Li/c1-12(2,3)14-10(13)11(15(4,5)6)16(7,8)9;/h13H,1-9H3;/q;+1/p-1.
What are the key properties of lithium 1-[(2-methylpropan-2-yl)oxy]-2,2-bis(trimethylsilyl)ethenolate?
lithium 1-[(2-methylpropan-2-yl)oxy]-2,2-bis(trimethylsilyl)ethenolate has a molecular weight of 266.46 g/mol, XLogP of 0.13, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for lithium 1-[(2-methylpropan-2-yl)oxy]-2,2-bis(trimethylsilyl)ethenolate is sourced from PubChem (CID 23707917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).