2-(2-hydroxyethoxy)acetic acid

C4H8O4 — CID 25935

IUPAC2-(2-hydroxyethoxy)acetic acid
SMILESO=C(O)COCCO
InChIInChI=1S/C4H8O4/c5-1-2-8-3-4(6)7/h5H,1-3H2,(H,6,7)
InChIKeyVDNMIIDPBBCMTM-UHFFFAOYSA-N
MW120.10 g/mol
LogP-0.92
Rot. Bonds4

About 2-(2-hydroxyethoxy)acetic acid

2-(2-hydroxyethoxy)acetic acid (PubChem CID 25935) has the molecular formula C4H8O4 and a molecular weight of 120.10 g/mol. Its IUPAC name is 2-(2-hydroxyethoxy)acetic acid.

Molecular Properties

Compound Name2-(2-hydroxyethoxy)acetic acid
PubChem CID25935
Molecular FormulaC4H8O4
Molecular Weight120.10 g/mol
Exact Mass120.04
IUPAC Name2-(2-hydroxyethoxy)acetic acid
SMILESO=C(O)COCCO
InChIInChI=1S/C4H8O4/c5-1-2-8-3-4(6)7/h5H,1-3H2,(H,6,7)
InChIKeyVDNMIIDPBBCMTM-UHFFFAOYSA-N
XLogP-0.92
TPSA66.76 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500120.10
LogP ≤ 5-0.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(2-hydroxyethoxy)acetic acid?
The IUPAC name of 2-(2-hydroxyethoxy)acetic acid (CID 25935) is 2-(2-hydroxyethoxy)acetic acid.
What is the SMILES notation for 2-(2-hydroxyethoxy)acetic acid?
The canonical SMILES for 2-(2-hydroxyethoxy)acetic acid is O=C(O)COCCO.
What is the InChIKey of 2-(2-hydroxyethoxy)acetic acid?
The InChIKey is VDNMIIDPBBCMTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8O4/c5-1-2-8-3-4(6)7/h5H,1-3H2,(H,6,7).
What are the key properties of 2-(2-hydroxyethoxy)acetic acid?
2-(2-hydroxyethoxy)acetic acid has a molecular weight of 120.10 g/mol, XLogP of -0.92, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydroxyethoxy)acetic acid is sourced from PubChem (CID 25935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).