1-methoxy-2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethylperoxy)ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethane

C22H46O20 — CID 118566183

About 1-methoxy-2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethylperoxy)ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethane

1-methoxy-2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethylperoxy)ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethane (PubChem CID 118566183) has the molecular formula C22H46O20 and a molecular weight of 630.59 g/mol. Its IUPAC name is 1-methoxy-2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethylperoxy)ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethane.

Molecular Properties

• Compound Name: 1-methoxy-2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethylperoxy)ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethane
• PubChem CID: 118566183
• Molecular Formula: C22H46O20
• Molecular Weight: 630.59 g/mol
• Exact Mass: 630.26
• IUPAC Name: 1-methoxy-2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethylperoxy)ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethane
• SMILES: COCCOOCCOOCCOOCCOOCCOOCCOOCCOOCCOOCCOOCCOC
• InChI: InChI=1S/C22H46O20/c1-23-3-5-25-27-7-9-29-31-11-13-33-35-15-17-37-39-19-21-41-42-22-20-40-38-18-16-36-34-14-12-32-30-10-8-28-26-6-4-24-2/h3-22H2,1-2H3
• InChIKey: SGXRYPMVQGNXRL-UHFFFAOYSA-N
• XLogP: -0.19
• TPSA: 184.60 Ų
• H-Bond Acceptors: 20
• Rotatable Bonds: 39
• Heavy Atoms: 42
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	630.59
LogP ≤ 5	-0.19
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	20

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'peroxide', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 1-methoxy-2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethylperoxy)ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethane?

The IUPAC name of 1-methoxy-2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethylperoxy)ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethane (CID 118566183) is 1-methoxy-2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethylperoxy)ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethane.

What is the SMILES notation for 1-methoxy-2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethylperoxy)ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethane?

The canonical SMILES for 1-methoxy-2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethylperoxy)ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethane is COCCOOCCOOCCOOCCOOCCOOCCOOCCOOCCOOCCOOCCOC.

What is the InChIKey of 1-methoxy-2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethylperoxy)ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethane?

The InChIKey is SGXRYPMVQGNXRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H46O20/c1-23-3-5-25-27-7-9-29-31-11-13-33-35-15-17-37-39-19-21-41-42-22-20-40-38-18-16-36-34-14-12-32-30-10-8-28-26-6-4-24-2/h3-22H2,1-2H3.

What are the key properties of 1-methoxy-2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethylperoxy)ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethane?

1-methoxy-2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethylperoxy)ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethane has a molecular weight of 630.59 g/mol, XLogP of -0.19, 39 rotatable bonds, 0 hydrogen bond donors, and 20 hydrogen bond acceptors.

Where does this data come from?

All data for 1-methoxy-2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethylperoxy)ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethane is sourced from PubChem (CID 118566183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).