trimethylsilyl 2-hydroxy-2-methylpropanoate

C7H16O3Si — CID 91694084

IUPACtrimethylsilyl 2-hydroxy-2-methylpropanoate
SMILESCC(C)(O)C(=O)O[Si](C)(C)C
InChIInChI=1S/C7H16O3Si/c1-7(2,9)6(8)10-11(3,4)5/h9H,1-5H3
InChIKeyIXEGDFGFFWAZFW-UHFFFAOYSA-N
MW176.29 g/mol
LogP1.14
Rot. Bonds2

About trimethylsilyl 2-hydroxy-2-methylpropanoate

trimethylsilyl 2-hydroxy-2-methylpropanoate (PubChem CID 91694084) has the molecular formula C7H16O3Si and a molecular weight of 176.29 g/mol. Its IUPAC name is trimethylsilyl 2-hydroxy-2-methylpropanoate.

Molecular Properties

Compound Nametrimethylsilyl 2-hydroxy-2-methylpropanoate
PubChem CID91694084
Molecular FormulaC7H16O3Si
Molecular Weight176.29 g/mol
Exact Mass176.09
IUPAC Nametrimethylsilyl 2-hydroxy-2-methylpropanoate
SMILESCC(C)(O)C(=O)O[Si](C)(C)C
InChIInChI=1S/C7H16O3Si/c1-7(2,9)6(8)10-11(3,4)5/h9H,1-5H3
InChIKeyIXEGDFGFFWAZFW-UHFFFAOYSA-N
XLogP1.14
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.29
LogP ≤ 51.14
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

Propanoic acid, 2-methyl-2-[(trimethylsilyl)oxy]-, trimethylsilyl ester
CID 521575
tert-Butyldimethylsilyl 2-hydroxy-2-methylpropanoate
CID 91697264
2-[Tert-butyl(dimethyl)silyl]-2-hydroxypropanoic acid
CID 17929545
t-Butyldimethylsiloxy lactic acid
CID 18962902
2-Methyl-2-trimethylsilyloxypropanoic acid
CID 54270259
2-[Tert-butyl(dimethyl)silyl]oxy-2-methylpropanoic acid
CID 86184106
Trimethylsilyl 2-hydroxy-2-trimethylsilyloxypropanoate
CID 87431804
Trimethylsilyl 2-hydroxy-2-methylbutanoate
CID 88062156
(2S)-2-[tert-butyl(dimethyl)silyl]oxy-2-hydroxypropanoic acid
CID 88122347
Trimethylsilyl 2-hydroxy-2-trimethylsilylpropanoate
CID 88172610
2-Methyl-2-trimethylsilyloxypent-3-ynoic acid
CID 88550167
2-Hydroxy-3-trimethylsilyl-2-(trimethylsilylmethyl)propanoic acid
CID 90891677

Frequently Asked Questions

What is the IUPAC name of trimethylsilyl 2-hydroxy-2-methylpropanoate?
The IUPAC name of trimethylsilyl 2-hydroxy-2-methylpropanoate (CID 91694084) is trimethylsilyl 2-hydroxy-2-methylpropanoate.
What is the SMILES notation for trimethylsilyl 2-hydroxy-2-methylpropanoate?
The canonical SMILES for trimethylsilyl 2-hydroxy-2-methylpropanoate is CC(C)(O)C(=O)O[Si](C)(C)C.
What is the InChIKey of trimethylsilyl 2-hydroxy-2-methylpropanoate?
The InChIKey is IXEGDFGFFWAZFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16O3Si/c1-7(2,9)6(8)10-11(3,4)5/h9H,1-5H3.
What are the key properties of trimethylsilyl 2-hydroxy-2-methylpropanoate?
trimethylsilyl 2-hydroxy-2-methylpropanoate has a molecular weight of 176.29 g/mol, XLogP of 1.14, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for trimethylsilyl 2-hydroxy-2-methylpropanoate is sourced from PubChem (CID 91694084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).