2-[2-(2-methoxyethoxy)ethoxy]acetic acid;zinc

C7H14O5Zn — CID 87575071

IUPAC2-[2-(2-methoxyethoxy)ethoxy]acetic acid;zinc
SMILESCOCCOCCOCC(=O)O.[Zn]
InChIInChI=1S/C7H14O5.Zn/c1-10-2-3-11-4-5-12-6-7(8)9;/h2-6H2,1H3,(H,8,9);
InChIKeyUNHXRYITRAFRGM-UHFFFAOYSA-N
MW243.57 g/mol
LogP-0.25
Rot. Bonds8

About 2-[2-(2-methoxyethoxy)ethoxy]acetic acid;zinc

2-[2-(2-methoxyethoxy)ethoxy]acetic acid;zinc (PubChem CID 87575071) has the molecular formula C7H14O5Zn and a molecular weight of 243.57 g/mol. Its IUPAC name is 2-[2-(2-methoxyethoxy)ethoxy]acetic acid;zinc.

Molecular Properties

Compound Name2-[2-(2-methoxyethoxy)ethoxy]acetic acid;zinc
PubChem CID87575071
Molecular FormulaC7H14O5Zn
Molecular Weight243.57 g/mol
Exact Mass242.01
IUPAC Name2-[2-(2-methoxyethoxy)ethoxy]acetic acid;zinc
SMILESCOCCOCCOCC(=O)O.[Zn]
InChIInChI=1S/C7H14O5.Zn/c1-10-2-3-11-4-5-12-6-7(8)9;/h2-6H2,1H3,(H,8,9);
InChIKeyUNHXRYITRAFRGM-UHFFFAOYSA-N
XLogP-0.25
TPSA64.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.57
LogP ≤ 5-0.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-methoxyethoxy)ethoxy]acetic acid;zinc?
The IUPAC name of 2-[2-(2-methoxyethoxy)ethoxy]acetic acid;zinc (CID 87575071) is 2-[2-(2-methoxyethoxy)ethoxy]acetic acid;zinc.
What is the SMILES notation for 2-[2-(2-methoxyethoxy)ethoxy]acetic acid;zinc?
The canonical SMILES for 2-[2-(2-methoxyethoxy)ethoxy]acetic acid;zinc is COCCOCCOCC(=O)O.[Zn].
What is the InChIKey of 2-[2-(2-methoxyethoxy)ethoxy]acetic acid;zinc?
The InChIKey is UNHXRYITRAFRGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14O5.Zn/c1-10-2-3-11-4-5-12-6-7(8)9;/h2-6H2,1H3,(H,8,9);.
What are the key properties of 2-[2-(2-methoxyethoxy)ethoxy]acetic acid;zinc?
2-[2-(2-methoxyethoxy)ethoxy]acetic acid;zinc has a molecular weight of 243.57 g/mol, XLogP of -0.25, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-methoxyethoxy)ethoxy]acetic acid;zinc is sourced from PubChem (CID 87575071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).