2-[2-[2-[2-[2-[2-[2-[2-(2-dodecoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]propoxy]propoxy]propoxy]propan-1-ol

C34H70O10 — CID 101170306

About 2-[2-[2-[2-[2-[2-[2-[2-(2-dodecoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]propoxy]propoxy]propoxy]propan-1-ol

2-[2-[2-[2-[2-[2-[2-[2-(2-dodecoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]propoxy]propoxy]propoxy]propan-1-ol (PubChem CID 101170306) has the molecular formula C34H70O10 and a molecular weight of 638.92 g/mol. Its IUPAC name is 2-[2-[2-[2-[2-[2-[2-[2-(2-dodecoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]propoxy]propoxy]propoxy]propan-1-ol.

Molecular Properties

• Compound Name: 2-[2-[2-[2-[2-[2-[2-[2-(2-dodecoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]propoxy]propoxy]propoxy]propan-1-ol
• PubChem CID: 101170306
• Molecular Formula: C34H70O10
• Molecular Weight: 638.92 g/mol
• Exact Mass: 638.50
• IUPAC Name: 2-[2-[2-[2-[2-[2-[2-[2-(2-dodecoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]propoxy]propoxy]propoxy]propan-1-ol
• SMILES: CCCCCCCCCCCCOCCOCCOCCOCCOCCOC(C)COC(C)COC(C)COC(C)CO
• InChI: InChI=1S/C34H70O10/c1-6-7-8-9-10-11-12-13-14-15-16-36-17-18-37-19-20-38-21-22-39-23-24-40-25-26-41-32(3)28-43-34(5)30-44-33(4)29-42-31(2)27-35/h31-35H,6-30H2,1-5H3
• InChIKey: QEGNQYVVLIVVTO-UHFFFAOYSA-N
• XLogP: 5.60
• TPSA: 103.30 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 10
• Rotatable Bonds: 37
• Heavy Atoms: 44
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	638.92
LogP ≤ 5	5.60
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	10

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-[2-[2-[2-[2-[2-[2-[2-(2-dodecoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]propoxy]propoxy]propoxy]propan-1-ol?

The IUPAC name of 2-[2-[2-[2-[2-[2-[2-[2-(2-dodecoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]propoxy]propoxy]propoxy]propan-1-ol (CID 101170306) is 2-[2-[2-[2-[2-[2-[2-[2-(2-dodecoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]propoxy]propoxy]propoxy]propan-1-ol.

What is the SMILES notation for 2-[2-[2-[2-[2-[2-[2-[2-(2-dodecoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]propoxy]propoxy]propoxy]propan-1-ol?

The canonical SMILES for 2-[2-[2-[2-[2-[2-[2-[2-(2-dodecoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]propoxy]propoxy]propoxy]propan-1-ol is CCCCCCCCCCCCOCCOCCOCCOCCOCCOC(C)COC(C)COC(C)COC(C)CO.

What is the InChIKey of 2-[2-[2-[2-[2-[2-[2-[2-(2-dodecoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]propoxy]propoxy]propoxy]propan-1-ol?

The InChIKey is QEGNQYVVLIVVTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H70O10/c1-6-7-8-9-10-11-12-13-14-15-16-36-17-18-37-19-20-38-21-22-39-23-24-40-25-26-41-32(3)28-43-34(5)30-44-33(4)29-42-31(2)27-35/h31-35H,6-30H2,1-5H3.

What are the key properties of 2-[2-[2-[2-[2-[2-[2-[2-(2-dodecoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]propoxy]propoxy]propoxy]propan-1-ol?

2-[2-[2-[2-[2-[2-[2-[2-(2-dodecoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]propoxy]propoxy]propoxy]propan-1-ol has a molecular weight of 638.92 g/mol, XLogP of 5.60, 37 rotatable bonds, 1 hydrogen bond donors, and 10 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[2-[2-[2-[2-[2-[2-[2-(2-dodecoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]propoxy]propoxy]propoxy]propan-1-ol is sourced from PubChem (CID 101170306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).