2-hydroxy-2-trimethylsilylpropanoic acid

C6H14O3Si — CID 15649138

IUPAC2-hydroxy-2-trimethylsilylpropanoic acid
SMILESCC(O)(C(=O)O)[Si](C)(C)C
InChIInChI=1S/C6H14O3Si/c1-6(9,5(7)8)10(2,3)4/h9H,1-4H3,(H,7,8)
InChIKeyUEGVGLHJWNWIJI-UHFFFAOYSA-N
MW162.26 g/mol
LogP0.70
Rot. Bonds2

About 2-hydroxy-2-trimethylsilylpropanoic acid

2-hydroxy-2-trimethylsilylpropanoic acid (PubChem CID 15649138) has the molecular formula C6H14O3Si and a molecular weight of 162.26 g/mol. Its IUPAC name is 2-hydroxy-2-trimethylsilylpropanoic acid.

Molecular Properties

Compound Name2-hydroxy-2-trimethylsilylpropanoic acid
PubChem CID15649138
Molecular FormulaC6H14O3Si
Molecular Weight162.26 g/mol
Exact Mass162.07
IUPAC Name2-hydroxy-2-trimethylsilylpropanoic acid
SMILESCC(O)(C(=O)O)[Si](C)(C)C
InChIInChI=1S/C6H14O3Si/c1-6(9,5(7)8)10(2,3)4/h9H,1-4H3,(H,7,8)
InChIKeyUEGVGLHJWNWIJI-UHFFFAOYSA-N
XLogP0.70
TPSA57.53 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.26
LogP ≤ 50.70
H-Bond Donors ≤ 52
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-hydroxy-2-trimethylsilylpropanoic acid?
The IUPAC name of 2-hydroxy-2-trimethylsilylpropanoic acid (CID 15649138) is 2-hydroxy-2-trimethylsilylpropanoic acid.
What is the SMILES notation for 2-hydroxy-2-trimethylsilylpropanoic acid?
The canonical SMILES for 2-hydroxy-2-trimethylsilylpropanoic acid is CC(O)(C(=O)O)[Si](C)(C)C.
What is the InChIKey of 2-hydroxy-2-trimethylsilylpropanoic acid?
The InChIKey is UEGVGLHJWNWIJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14O3Si/c1-6(9,5(7)8)10(2,3)4/h9H,1-4H3,(H,7,8).
What are the key properties of 2-hydroxy-2-trimethylsilylpropanoic acid?
2-hydroxy-2-trimethylsilylpropanoic acid has a molecular weight of 162.26 g/mol, XLogP of 0.70, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-2-trimethylsilylpropanoic acid is sourced from PubChem (CID 15649138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).