2-methyl-2-trimethylsilyloxypropanoic acid

C7H16O3Si — CID 54270259

IUPAC2-methyl-2-trimethylsilyloxypropanoic acid
SMILESCC(C)(O[Si](C)(C)C)C(=O)O
InChIInChI=1S/C7H16O3Si/c1-7(2,6(8)9)10-11(3,4)5/h1-5H3,(H,8,9)
InChIKeyRJPPUYVYZJSENI-UHFFFAOYSA-N
MW176.29 g/mol
LogP1.70
Rot. Bonds3

About 2-methyl-2-trimethylsilyloxypropanoic acid

2-methyl-2-trimethylsilyloxypropanoic acid (PubChem CID 54270259) has the molecular formula C7H16O3Si and a molecular weight of 176.29 g/mol. Its IUPAC name is 2-methyl-2-trimethylsilyloxypropanoic acid.

Molecular Properties

Compound Name2-methyl-2-trimethylsilyloxypropanoic acid
PubChem CID54270259
Molecular FormulaC7H16O3Si
Molecular Weight176.29 g/mol
Exact Mass176.09
IUPAC Name2-methyl-2-trimethylsilyloxypropanoic acid
SMILESCC(C)(O[Si](C)(C)C)C(=O)O
InChIInChI=1S/C7H16O3Si/c1-7(2,6(8)9)10-11(3,4)5/h1-5H3,(H,8,9)
InChIKeyRJPPUYVYZJSENI-UHFFFAOYSA-N
XLogP1.70
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.29
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-trimethylsilyloxypropanoic acid?
The IUPAC name of 2-methyl-2-trimethylsilyloxypropanoic acid (CID 54270259) is 2-methyl-2-trimethylsilyloxypropanoic acid.
What is the SMILES notation for 2-methyl-2-trimethylsilyloxypropanoic acid?
The canonical SMILES for 2-methyl-2-trimethylsilyloxypropanoic acid is CC(C)(O[Si](C)(C)C)C(=O)O.
What is the InChIKey of 2-methyl-2-trimethylsilyloxypropanoic acid?
The InChIKey is RJPPUYVYZJSENI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16O3Si/c1-7(2,6(8)9)10-11(3,4)5/h1-5H3,(H,8,9).
What are the key properties of 2-methyl-2-trimethylsilyloxypropanoic acid?
2-methyl-2-trimethylsilyloxypropanoic acid has a molecular weight of 176.29 g/mol, XLogP of 1.70, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-trimethylsilyloxypropanoic acid is sourced from PubChem (CID 54270259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).