2-(2-hydroxyacetyl)oxyacetic acid

C4H6O5 — CID 11094663

IUPAC2-(2-hydroxyacetyl)oxyacetic acid
SMILESO=C(O)COC(=O)CO
InChIInChI=1S/C4H6O5/c5-1-4(8)9-2-3(6)7/h5H,1-2H2,(H,6,7)
InChIKeyNYCQHRWCDWJIEG-UHFFFAOYSA-N
MW134.09 g/mol
LogP-1.39
Rot. Bonds3

About 2-(2-hydroxyacetyl)oxyacetic acid

2-(2-hydroxyacetyl)oxyacetic acid (PubChem CID 11094663) has the molecular formula C4H6O5 and a molecular weight of 134.09 g/mol. Its IUPAC name is 2-(2-hydroxyacetyl)oxyacetic acid.

Molecular Properties

Compound Name2-(2-hydroxyacetyl)oxyacetic acid
PubChem CID11094663
Molecular FormulaC4H6O5
Molecular Weight134.09 g/mol
Exact Mass134.02
IUPAC Name2-(2-hydroxyacetyl)oxyacetic acid
SMILESO=C(O)COC(=O)CO
InChIInChI=1S/C4H6O5/c5-1-4(8)9-2-3(6)7/h5H,1-2H2,(H,6,7)
InChIKeyNYCQHRWCDWJIEG-UHFFFAOYSA-N
XLogP-1.39
TPSA83.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.09
LogP ≤ 5-1.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(2-hydroxyacetyl)oxyacetic acid?
The IUPAC name of 2-(2-hydroxyacetyl)oxyacetic acid (CID 11094663) is 2-(2-hydroxyacetyl)oxyacetic acid.
What is the SMILES notation for 2-(2-hydroxyacetyl)oxyacetic acid?
The canonical SMILES for 2-(2-hydroxyacetyl)oxyacetic acid is O=C(O)COC(=O)CO.
What is the InChIKey of 2-(2-hydroxyacetyl)oxyacetic acid?
The InChIKey is NYCQHRWCDWJIEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H6O5/c5-1-4(8)9-2-3(6)7/h5H,1-2H2,(H,6,7).
What are the key properties of 2-(2-hydroxyacetyl)oxyacetic acid?
2-(2-hydroxyacetyl)oxyacetic acid has a molecular weight of 134.09 g/mol, XLogP of -1.39, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydroxyacetyl)oxyacetic acid is sourced from PubChem (CID 11094663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).