ethyl 2-hydroxyacetate

C4H8O3 — CID 12184

IUPACethyl 2-hydroxyacetate
SMILESCCOC(=O)CO
InChIInChI=1S/C4H8O3/c1-2-7-4(6)3-5/h5H,2-3H2,1H3
InChIKeyZANNOFHADGWOLI-UHFFFAOYSA-N
MW104.11 g/mol
LogP-0.46
Rot. Bonds2

About ethyl 2-hydroxyacetate

ethyl 2-hydroxyacetate (PubChem CID 12184) has the molecular formula C4H8O3 and a molecular weight of 104.11 g/mol. Its IUPAC name is ethyl 2-hydroxyacetate.

Molecular Properties

Compound Nameethyl 2-hydroxyacetate
PubChem CID12184
Molecular FormulaC4H8O3
Molecular Weight104.11 g/mol
Exact Mass104.05
IUPAC Nameethyl 2-hydroxyacetate
SMILESCCOC(=O)CO
InChIInChI=1S/C4H8O3/c1-2-7-4(6)3-5/h5H,2-3H2,1H3
InChIKeyZANNOFHADGWOLI-UHFFFAOYSA-N
XLogP-0.46
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500104.11
LogP ≤ 5-0.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Ethyl Lactate
CID 7344
Butyl Lactate
CID 8738
Ethoxyacetic acid
CID 12301
(L)-ethyl lactate
CID 92831
Propyl lactate, (+-)-
CID 92821
Butoxyacetic acid
CID 41958
Butyl lactate, (S)-
CID 6999977
Glycol monoacetate
CID 10960
Butyl Glycolate
CID 81882
Propanoic acid, 2-hydroxy-, 1-methylpropyl ester
CID 86741
Isopropyl Lactate
CID 61160
Methyl Glycolate
CID 66774

Frequently Asked Questions

What is the IUPAC name of ethyl 2-hydroxyacetate?
The IUPAC name of ethyl 2-hydroxyacetate (CID 12184) is ethyl 2-hydroxyacetate.
What is the SMILES notation for ethyl 2-hydroxyacetate?
The canonical SMILES for ethyl 2-hydroxyacetate is CCOC(=O)CO.
What is the InChIKey of ethyl 2-hydroxyacetate?
The InChIKey is ZANNOFHADGWOLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8O3/c1-2-7-4(6)3-5/h5H,2-3H2,1H3.
What are the key properties of ethyl 2-hydroxyacetate?
ethyl 2-hydroxyacetate has a molecular weight of 104.11 g/mol, XLogP of -0.46, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-hydroxyacetate is sourced from PubChem (CID 12184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).