2-(2-ethenoxyethoxy)ethanol;2-[2-(2-hydroxyethoxy)ethoxy]ethanol

C12H26O7 — CID 159459473

About 2-(2-ethenoxyethoxy)ethanol;2-[2-(2-hydroxyethoxy)ethoxy]ethanol

2-(2-ethenoxyethoxy)ethanol;2-[2-(2-hydroxyethoxy)ethoxy]ethanol (PubChem CID 159459473) has the molecular formula C12H26O7 and a molecular weight of 282.33 g/mol. Its IUPAC name is 2-(2-ethenoxyethoxy)ethanol;2-[2-(2-hydroxyethoxy)ethoxy]ethanol.

Molecular Properties

• Compound Name: 2-(2-ethenoxyethoxy)ethanol;2-[2-(2-hydroxyethoxy)ethoxy]ethanol
• PubChem CID: 159459473
• Molecular Formula: C12H26O7
• Molecular Weight: 282.33 g/mol
• Exact Mass: 282.17
• IUPAC Name: 2-(2-ethenoxyethoxy)ethanol;2-[2-(2-hydroxyethoxy)ethoxy]ethanol
• SMILES: C=COCCOCCO.OCCOCCOCCO
• InChI: InChI=1S/C6H14O4.C6H12O3/c7-1-3-9-5-6-10-4-2-8;1-2-8-5-6-9-4-3-7/h7-8H,1-6H2;2,7H,1,3-6H2
• InChIKey: LUKFDPQNEDQVSD-UHFFFAOYSA-N
• XLogP: -0.84
• TPSA: 97.61 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 7
• Rotatable Bonds: 13
• Heavy Atoms: 19
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	282.33
LogP ≤ 5	-0.84
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	7

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Frequently Asked Questions

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

The IUPAC name of 2-(2-ethenoxyethoxy)ethanol;2-[2-(2-hydroxyethoxy)ethoxy]ethanol (CID 159459473) is 2-(2-ethenoxyethoxy)ethanol;2-[2-(2-hydroxyethoxy)ethoxy]ethanol.

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

The canonical SMILES for 2-(2-ethenoxyethoxy)ethanol;2-[2-(2-hydroxyethoxy)ethoxy]ethanol is C=COCCOCCO.OCCOCCOCCO.

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

The InChIKey is LUKFDPQNEDQVSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14O4.C6H12O3/c7-1-3-9-5-6-10-4-2-8;1-2-8-5-6-9-4-3-7/h7-8H,1-6H2;2,7H,1,3-6H2.

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

2-(2-ethenoxyethoxy)ethanol;2-[2-(2-hydroxyethoxy)ethoxy]ethanol has a molecular weight of 282.33 g/mol, XLogP of -0.84, 13 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(2-ethenoxyethoxy)ethanol;2-[2-(2-hydroxyethoxy)ethoxy]ethanol is sourced from PubChem (CID 159459473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).