2-[2-[2-[2-(2-hydroxyethoxy)ethylsulfanyloxy]ethoxy]ethoxy]ethanol

C10H22O6S — CID 87997733

About 2-[2-[2-[2-(2-hydroxyethoxy)ethylsulfanyloxy]ethoxy]ethoxy]ethanol

2-[2-[2-[2-(2-hydroxyethoxy)ethylsulfanyloxy]ethoxy]ethoxy]ethanol (PubChem CID 87997733) has the molecular formula C10H22O6S and a molecular weight of 270.35 g/mol. Its IUPAC name is 2-[2-[2-[2-(2-hydroxyethoxy)ethylsulfanyloxy]ethoxy]ethoxy]ethanol.

Molecular Properties

• Compound Name: 2-[2-[2-[2-(2-hydroxyethoxy)ethylsulfanyloxy]ethoxy]ethoxy]ethanol
• PubChem CID: 87997733
• Molecular Formula: C10H22O6S
• Molecular Weight: 270.35 g/mol
• Exact Mass: 270.11
• IUPAC Name: 2-[2-[2-[2-(2-hydroxyethoxy)ethylsulfanyloxy]ethoxy]ethoxy]ethanol
• SMILES: OCCOCCOCCOSCCOCCO
• InChI: InChI=1S/C10H22O6S/c11-1-3-13-5-6-15-7-8-16-17-10-9-14-4-2-12/h11-12H,1-10H2
• InChIKey: GJZXMLUNEQZFNS-UHFFFAOYSA-N
• XLogP: -0.31
• TPSA: 77.38 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 7
• Rotatable Bonds: 14
• Heavy Atoms: 17
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	270.35
LogP ≤ 5	-0.31
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	7

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-[2-[2-[2-(2-hydroxyethoxy)ethylsulfanyloxy]ethoxy]ethoxy]ethanol?

The IUPAC name of 2-[2-[2-[2-(2-hydroxyethoxy)ethylsulfanyloxy]ethoxy]ethoxy]ethanol (CID 87997733) is 2-[2-[2-[2-(2-hydroxyethoxy)ethylsulfanyloxy]ethoxy]ethoxy]ethanol.

What is the SMILES notation for 2-[2-[2-[2-(2-hydroxyethoxy)ethylsulfanyloxy]ethoxy]ethoxy]ethanol?

The canonical SMILES for 2-[2-[2-[2-(2-hydroxyethoxy)ethylsulfanyloxy]ethoxy]ethoxy]ethanol is OCCOCCOCCOSCCOCCO.

What is the InChIKey of 2-[2-[2-[2-(2-hydroxyethoxy)ethylsulfanyloxy]ethoxy]ethoxy]ethanol?

The InChIKey is GJZXMLUNEQZFNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22O6S/c11-1-3-13-5-6-15-7-8-16-17-10-9-14-4-2-12/h11-12H,1-10H2.

What are the key properties of 2-[2-[2-[2-(2-hydroxyethoxy)ethylsulfanyloxy]ethoxy]ethoxy]ethanol?

2-[2-[2-[2-(2-hydroxyethoxy)ethylsulfanyloxy]ethoxy]ethoxy]ethanol has a molecular weight of 270.35 g/mol, XLogP of -0.31, 14 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[2-[2-[2-(2-hydroxyethoxy)ethylsulfanyloxy]ethoxy]ethoxy]ethanol is sourced from PubChem (CID 87997733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).