methoxymethyl 2-methoxyacetate

C5H10O4 — CID 18714495

IUPACmethoxymethyl 2-methoxyacetate
SMILESCOCOC(=O)COC
InChIInChI=1S/C5H10O4/c1-7-3-5(6)9-4-8-2/h3-4H2,1-2H3
InChIKeyMOJICAXZCYIAGS-UHFFFAOYSA-N
MW134.13 g/mol
LogP-0.22
Rot. Bonds4

About methoxymethyl 2-methoxyacetate

methoxymethyl 2-methoxyacetate (PubChem CID 18714495) has the molecular formula C5H10O4 and a molecular weight of 134.13 g/mol. Its IUPAC name is methoxymethyl 2-methoxyacetate.

Molecular Properties

Compound Namemethoxymethyl 2-methoxyacetate
PubChem CID18714495
Molecular FormulaC5H10O4
Molecular Weight134.13 g/mol
Exact Mass134.06
IUPAC Namemethoxymethyl 2-methoxyacetate
SMILESCOCOC(=O)COC
InChIInChI=1S/C5H10O4/c1-7-3-5(6)9-4-8-2/h3-4H2,1-2H3
InChIKeyMOJICAXZCYIAGS-UHFFFAOYSA-N
XLogP-0.22
TPSA44.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.13
LogP ≤ 5-0.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of methoxymethyl 2-methoxyacetate?
The IUPAC name of methoxymethyl 2-methoxyacetate (CID 18714495) is methoxymethyl 2-methoxyacetate.
What is the SMILES notation for methoxymethyl 2-methoxyacetate?
The canonical SMILES for methoxymethyl 2-methoxyacetate is COCOC(=O)COC.
What is the InChIKey of methoxymethyl 2-methoxyacetate?
The InChIKey is MOJICAXZCYIAGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10O4/c1-7-3-5(6)9-4-8-2/h3-4H2,1-2H3.
What are the key properties of methoxymethyl 2-methoxyacetate?
methoxymethyl 2-methoxyacetate has a molecular weight of 134.13 g/mol, XLogP of -0.22, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methoxymethyl 2-methoxyacetate is sourced from PubChem (CID 18714495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).