2-(1-methoxyethoxy)acetic acid;zinc

C5H10O4Zn — CID 174204539

IUPAC2-(1-methoxyethoxy)acetic acid;zinc
SMILESCOC(C)OCC(=O)O.[Zn]
InChIInChI=1S/C5H10O4.Zn/c1-4(8-2)9-3-5(6)7;/h4H,3H2,1-2H3,(H,6,7);
InChIKeyFCKTVIZBMDWYKI-UHFFFAOYSA-N
MW199.52 g/mol
LogP0.08
Rot. Bonds4

About 2-(1-methoxyethoxy)acetic acid;zinc

2-(1-methoxyethoxy)acetic acid;zinc (PubChem CID 174204539) has the molecular formula C5H10O4Zn and a molecular weight of 199.52 g/mol. Its IUPAC name is 2-(1-methoxyethoxy)acetic acid;zinc.

Molecular Properties

Compound Name2-(1-methoxyethoxy)acetic acid;zinc
PubChem CID174204539
Molecular FormulaC5H10O4Zn
Molecular Weight199.52 g/mol
Exact Mass197.99
IUPAC Name2-(1-methoxyethoxy)acetic acid;zinc
SMILESCOC(C)OCC(=O)O.[Zn]
InChIInChI=1S/C5H10O4.Zn/c1-4(8-2)9-3-5(6)7;/h4H,3H2,1-2H3,(H,6,7);
InChIKeyFCKTVIZBMDWYKI-UHFFFAOYSA-N
XLogP0.08
TPSA55.76 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms10
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.52
LogP ≤ 50.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', '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 2-(1-methoxyethoxy)acetic acid;zinc?
The IUPAC name of 2-(1-methoxyethoxy)acetic acid;zinc (CID 174204539) is 2-(1-methoxyethoxy)acetic acid;zinc.
What is the SMILES notation for 2-(1-methoxyethoxy)acetic acid;zinc?
The canonical SMILES for 2-(1-methoxyethoxy)acetic acid;zinc is COC(C)OCC(=O)O.[Zn].
What is the InChIKey of 2-(1-methoxyethoxy)acetic acid;zinc?
The InChIKey is FCKTVIZBMDWYKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10O4.Zn/c1-4(8-2)9-3-5(6)7;/h4H,3H2,1-2H3,(H,6,7);.
What are the key properties of 2-(1-methoxyethoxy)acetic acid;zinc?
2-(1-methoxyethoxy)acetic acid;zinc has a molecular weight of 199.52 g/mol, XLogP of 0.08, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methoxyethoxy)acetic acid;zinc is sourced from PubChem (CID 174204539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).