trimethylsilylmethyl 2-hydroxyacetate

C6H14O3Si — CID 58637933

IUPACtrimethylsilylmethyl 2-hydroxyacetate
SMILESC[Si](C)(C)COC(=O)CO
InChIInChI=1S/C6H14O3Si/c1-10(2,3)5-9-6(8)4-7/h7H,4-5H2,1-3H3
InChIKeyWRJVGPQABAVUCL-UHFFFAOYSA-N
MW162.26 g/mol
LogP0.40
Rot. Bonds3

About trimethylsilylmethyl 2-hydroxyacetate

trimethylsilylmethyl 2-hydroxyacetate (PubChem CID 58637933) has the molecular formula C6H14O3Si and a molecular weight of 162.26 g/mol. Its IUPAC name is trimethylsilylmethyl 2-hydroxyacetate.

Molecular Properties

Compound Nametrimethylsilylmethyl 2-hydroxyacetate
PubChem CID58637933
Molecular FormulaC6H14O3Si
Molecular Weight162.26 g/mol
Exact Mass162.07
IUPAC Nametrimethylsilylmethyl 2-hydroxyacetate
SMILESC[Si](C)(C)COC(=O)CO
InChIInChI=1S/C6H14O3Si/c1-10(2,3)5-9-6(8)4-7/h7H,4-5H2,1-3H3
InChIKeyWRJVGPQABAVUCL-UHFFFAOYSA-N
XLogP0.40
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.26
LogP ≤ 50.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(2-hydroxyacetyl)oxymethyl 2-hydroxyacetate;methane
CID 161332645
barium(2+);ethyl 2-hydroxyacetate;hydride
CID 173419911
potassium;ethyl 2-hydroxyacetate;hydride
CID 174939573
trimethylsilylmethyl 2-fluoroprop-2-enoate
CID 71339155
1-O-methyl 4-O-(trimethylsilylmethyl) (E)-but-2-enedioate
CID 139675883
(2-ethoxy-2-oxoethyl) 2-hydroxyacetate
CID 57037342
ethane-1,2-diol;2-(2-hydroxyacetyl)oxyethyl 2-hydroxyacetate;methane
CID 163645846
2-methylsulfanylethyl 2-hydroxyacetate
CID 127010328
2-aminoethyl 2-hydroxyacetate;N,N-dimethylmethanamine
CID 174615964
trimethylsilylmethyl 4-aminobenzoate
CID 13238788
2-chloroethyl 2-hydroxyacetate
CID 10034696
hexacosyl 2-hydroxyacetate
CID 156789960

Frequently Asked Questions

What is the IUPAC name of trimethylsilylmethyl 2-hydroxyacetate?
The IUPAC name of trimethylsilylmethyl 2-hydroxyacetate (CID 58637933) is trimethylsilylmethyl 2-hydroxyacetate.
What is the SMILES notation for trimethylsilylmethyl 2-hydroxyacetate?
The canonical SMILES for trimethylsilylmethyl 2-hydroxyacetate is C[Si](C)(C)COC(=O)CO.
What is the InChIKey of trimethylsilylmethyl 2-hydroxyacetate?
The InChIKey is WRJVGPQABAVUCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14O3Si/c1-10(2,3)5-9-6(8)4-7/h7H,4-5H2,1-3H3.
What are the key properties of trimethylsilylmethyl 2-hydroxyacetate?
trimethylsilylmethyl 2-hydroxyacetate has a molecular weight of 162.26 g/mol, XLogP of 0.40, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for trimethylsilylmethyl 2-hydroxyacetate is sourced from PubChem (CID 58637933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).