[carboxy-[dicarboxy(methyl)silyl]oxy-methylsilyl]formic acid

C6H10O9Si2 — CID 87995650

IUPAC[carboxy-[dicarboxy(methyl)silyl]oxy-methylsilyl]formic acid
SMILESC[Si](O[Si](C)(C(=O)O)C(=O)O)(C(=O)O)C(=O)O
InChIInChI=1S/C6H10O9Si2/c1-16(3(7)8,4(9)10)15-17(2,5(11)12)6(13)14/h1-2H3,(H,7,8)(H,9,10)(H,11,12)(H,13,14)
InChIKeyTYSZKXAUHWNPMO-UHFFFAOYSA-N
MW282.31 g/mol
LogP1.19
Rot. Bonds6

About [carboxy-[dicarboxy(methyl)silyl]oxy-methylsilyl]formic acid

[carboxy-[dicarboxy(methyl)silyl]oxy-methylsilyl]formic acid (PubChem CID 87995650) has the molecular formula C6H10O9Si2 and a molecular weight of 282.31 g/mol. Its IUPAC name is [carboxy-[dicarboxy(methyl)silyl]oxy-methylsilyl]formic acid.

Molecular Properties

Compound Name[carboxy-[dicarboxy(methyl)silyl]oxy-methylsilyl]formic acid
PubChem CID87995650
Molecular FormulaC6H10O9Si2
Molecular Weight282.31 g/mol
Exact Mass281.99
IUPAC Name[carboxy-[dicarboxy(methyl)silyl]oxy-methylsilyl]formic acid
SMILESC[Si](O[Si](C)(C(=O)O)C(=O)O)(C(=O)O)C(=O)O
InChIInChI=1S/C6H10O9Si2/c1-16(3(7)8,4(9)10)15-17(2,5(11)12)6(13)14/h1-2H3,(H,7,8)(H,9,10)(H,11,12)(H,13,14)
InChIKeyTYSZKXAUHWNPMO-UHFFFAOYSA-N
XLogP1.19
TPSA158.43 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.31
LogP ≤ 51.19
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

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-[dicarboxy(methyl)silyl]oxy-methylsilyl]formic acid?
The IUPAC name of [carboxy-[dicarboxy(methyl)silyl]oxy-methylsilyl]formic acid (CID 87995650) is [carboxy-[dicarboxy(methyl)silyl]oxy-methylsilyl]formic acid.
What is the SMILES notation for [carboxy-[dicarboxy(methyl)silyl]oxy-methylsilyl]formic acid?
The canonical SMILES for [carboxy-[dicarboxy(methyl)silyl]oxy-methylsilyl]formic acid is C[Si](O[Si](C)(C(=O)O)C(=O)O)(C(=O)O)C(=O)O.
What is the InChIKey of [carboxy-[dicarboxy(methyl)silyl]oxy-methylsilyl]formic acid?
The InChIKey is TYSZKXAUHWNPMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10O9Si2/c1-16(3(7)8,4(9)10)15-17(2,5(11)12)6(13)14/h1-2H3,(H,7,8)(H,9,10)(H,11,12)(H,13,14).
What are the key properties of [carboxy-[dicarboxy(methyl)silyl]oxy-methylsilyl]formic acid?
[carboxy-[dicarboxy(methyl)silyl]oxy-methylsilyl]formic acid has a molecular weight of 282.31 g/mol, XLogP of 1.19, 6 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [carboxy-[dicarboxy(methyl)silyl]oxy-methylsilyl]formic acid is sourced from PubChem (CID 87995650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).