[carboxy(dimethyl)silyl]formic acid

C4H8O4Si — CID 87229118

IUPAC[carboxy(dimethyl)silyl]formic acid
SMILESC[Si](C)(C(=O)O)C(=O)O
InChIInChI=1S/C4H8O4Si/c1-9(2,3(5)6)4(7)8/h1-2H3,(H,5,6)(H,7,8)
InChIKeyOPIIYVWDRMRDFL-UHFFFAOYSA-N
MW148.19 g/mol
LogP1.21
Rot. Bonds2

About [carboxy(dimethyl)silyl]formic acid

[carboxy(dimethyl)silyl]formic acid (PubChem CID 87229118) has the molecular formula C4H8O4Si and a molecular weight of 148.19 g/mol. Its IUPAC name is [carboxy(dimethyl)silyl]formic acid.

Molecular Properties

Compound Name[carboxy(dimethyl)silyl]formic acid
PubChem CID87229118
Molecular FormulaC4H8O4Si
Molecular Weight148.19 g/mol
Exact Mass148.02
IUPAC Name[carboxy(dimethyl)silyl]formic acid
SMILESC[Si](C)(C(=O)O)C(=O)O
InChIInChI=1S/C4H8O4Si/c1-9(2,3(5)6)4(7)8/h1-2H3,(H,5,6)(H,7,8)
InChIKeyOPIIYVWDRMRDFL-UHFFFAOYSA-N
XLogP1.21
TPSA74.60 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.19
LogP ≤ 51.21
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 [carboxy(dimethyl)silyl]formic acid?
The IUPAC name of [carboxy(dimethyl)silyl]formic acid (CID 87229118) is [carboxy(dimethyl)silyl]formic acid.
What is the SMILES notation for [carboxy(dimethyl)silyl]formic acid?
The canonical SMILES for [carboxy(dimethyl)silyl]formic acid is C[Si](C)(C(=O)O)C(=O)O.
What is the InChIKey of [carboxy(dimethyl)silyl]formic acid?
The InChIKey is OPIIYVWDRMRDFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8O4Si/c1-9(2,3(5)6)4(7)8/h1-2H3,(H,5,6)(H,7,8).
What are the key properties of [carboxy(dimethyl)silyl]formic acid?
[carboxy(dimethyl)silyl]formic acid has a molecular weight of 148.19 g/mol, XLogP of 1.21, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [carboxy(dimethyl)silyl]formic acid is sourced from PubChem (CID 87229118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).