ethyl 2-(methoxymethoxy)acetate

C6H12O4 — CID 23243227

IUPACethyl 2-(methoxymethoxy)acetate
SMILESCCOC(=O)COCOC
InChIInChI=1S/C6H12O4/c1-3-10-6(7)4-9-5-8-2/h3-5H2,1-2H3
InChIKeyIWVXKWZGMBIDMO-UHFFFAOYSA-N
MW148.16 g/mol
LogP0.17
Rot. Bonds5

About ethyl 2-(methoxymethoxy)acetate

ethyl 2-(methoxymethoxy)acetate (PubChem CID 23243227) has the molecular formula C6H12O4 and a molecular weight of 148.16 g/mol. Its IUPAC name is ethyl 2-(methoxymethoxy)acetate.

Molecular Properties

Compound Nameethyl 2-(methoxymethoxy)acetate
PubChem CID23243227
Molecular FormulaC6H12O4
Molecular Weight148.16 g/mol
Exact Mass148.07
IUPAC Nameethyl 2-(methoxymethoxy)acetate
SMILESCCOC(=O)COCOC
InChIInChI=1S/C6H12O4/c1-3-10-6(7)4-9-5-8-2/h3-5H2,1-2H3
InChIKeyIWVXKWZGMBIDMO-UHFFFAOYSA-N
XLogP0.17
TPSA44.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.16
LogP ≤ 50.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of ethyl 2-(methoxymethoxy)acetate?
The IUPAC name of ethyl 2-(methoxymethoxy)acetate (CID 23243227) is ethyl 2-(methoxymethoxy)acetate.
What is the SMILES notation for ethyl 2-(methoxymethoxy)acetate?
The canonical SMILES for ethyl 2-(methoxymethoxy)acetate is CCOC(=O)COCOC.
What is the InChIKey of ethyl 2-(methoxymethoxy)acetate?
The InChIKey is IWVXKWZGMBIDMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12O4/c1-3-10-6(7)4-9-5-8-2/h3-5H2,1-2H3.
What are the key properties of ethyl 2-(methoxymethoxy)acetate?
ethyl 2-(methoxymethoxy)acetate has a molecular weight of 148.16 g/mol, XLogP of 0.17, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-(methoxymethoxy)acetate is sourced from PubChem (CID 23243227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).