zinc;carbanide;1-methoxy-2-(2-methoxyethoxy)ethane

C8H20O3Zn — CID 161464033

About zinc;carbanide;1-methoxy-2-(2-methoxyethoxy)ethane

zinc;carbanide;1-methoxy-2-(2-methoxyethoxy)ethane (PubChem CID 161464033) has the molecular formula C8H20O3Zn and a molecular weight of 229.63 g/mol. Its IUPAC name is zinc;carbanide;1-methoxy-2-(2-methoxyethoxy)ethane.

Molecular Properties

• Compound Name: zinc;carbanide;1-methoxy-2-(2-methoxyethoxy)ethane
• PubChem CID: 161464033
• Molecular Formula: C8H20O3Zn
• Molecular Weight: 229.63 g/mol
• Exact Mass: 228.07
• IUPAC Name: zinc;carbanide;1-methoxy-2-(2-methoxyethoxy)ethane
• SMILES: COCCOCCOC.[CH3-].[CH3-].[Zn+2]
• InChI: InChI=1S/C6H14O3.2CH3.Zn/c1-7-3-5-9-6-4-8-2;;;/h3-6H2,1-2H3;2*1H3;/q;2*-1;+2
• InChIKey: ZZYOZNWEFMSNCN-UHFFFAOYSA-N
• XLogP: 1.19
• TPSA: 27.69 Ų
• H-Bond Acceptors: 3
• Rotatable Bonds: 6
• Heavy Atoms: 12
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	229.63
LogP ≤ 5	1.19
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	3

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of zinc;carbanide;1-methoxy-2-(2-methoxyethoxy)ethane?

The IUPAC name of zinc;carbanide;1-methoxy-2-(2-methoxyethoxy)ethane (CID 161464033) is zinc;carbanide;1-methoxy-2-(2-methoxyethoxy)ethane.

What is the SMILES notation for zinc;carbanide;1-methoxy-2-(2-methoxyethoxy)ethane?

The canonical SMILES for zinc;carbanide;1-methoxy-2-(2-methoxyethoxy)ethane is COCCOCCOC.[CH3-].[CH3-].[Zn+2].

What is the InChIKey of zinc;carbanide;1-methoxy-2-(2-methoxyethoxy)ethane?

The InChIKey is ZZYOZNWEFMSNCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14O3.2CH3.Zn/c1-7-3-5-9-6-4-8-2;;;/h3-6H2,1-2H3;2*1H3;/q;2*-1;+2.

What are the key properties of zinc;carbanide;1-methoxy-2-(2-methoxyethoxy)ethane?

zinc;carbanide;1-methoxy-2-(2-methoxyethoxy)ethane has a molecular weight of 229.63 g/mol, XLogP of 1.19, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for zinc;carbanide;1-methoxy-2-(2-methoxyethoxy)ethane is sourced from PubChem (CID 161464033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).