2-(2-hydroxyethoxy)ethanol;2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethanol;tetrakis(2-methylprop-2-enoate)

C28H48O16-4 — CID 18957552

About 2-(2-hydroxyethoxy)ethanol;2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethanol;tetrakis(2-methylprop-2-enoate)

2-(2-hydroxyethoxy)ethanol;2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethanol;tetrakis(2-methylprop-2-enoate) (PubChem CID 18957552) has the molecular formula C28H48O16-4 and a molecular weight of 640.68 g/mol. Its IUPAC name is 2-(2-hydroxyethoxy)ethanol;2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethanol;tetrakis(2-methylprop-2-enoate).

Molecular Properties

• Compound Name: 2-(2-hydroxyethoxy)ethanol;2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethanol;tetrakis(2-methylprop-2-enoate)
• PubChem CID: 18957552
• Molecular Formula: C28H48O16-4
• Molecular Weight: 640.68 g/mol
• Exact Mass: 640.30
• IUPAC Name: 2-(2-hydroxyethoxy)ethanol;2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethanol;tetrakis(2-methylprop-2-enoate)
• SMILES: C=C(C)C(=O)[O-].C=C(C)C(=O)[O-].C=C(C)C(=O)[O-].C=C(C)C(=O)[O-].OCCOCCO.OCCOCCOCCOCCO
• InChI: InChI=1S/C8H18O5.C4H10O3.4C4H6O2/c9-1-3-11-5-7-13-8-6-12-4-2-10;5-1-3-7-4-2-6;4*1-3(2)4(5)6/h9-10H,1-8H2;5-6H,1-4H2;4*1H2,2H3,(H,5,6)/p-4
• InChIKey: BSPLTXBAULHMBL-UHFFFAOYSA-J
• XLogP: -4.74
• TPSA: 278.36 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 16
• Rotatable Bonds: 18
• Heavy Atoms: 44
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	640.68
LogP ≤ 5	-4.74
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	16

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Frequently Asked Questions

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

The IUPAC name of 2-(2-hydroxyethoxy)ethanol;2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethanol;tetrakis(2-methylprop-2-enoate) (CID 18957552) is 2-(2-hydroxyethoxy)ethanol;2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethanol;tetrakis(2-methylprop-2-enoate).

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

The canonical SMILES for 2-(2-hydroxyethoxy)ethanol;2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethanol;tetrakis(2-methylprop-2-enoate) is C=C(C)C(=O)[O-].C=C(C)C(=O)[O-].C=C(C)C(=O)[O-].C=C(C)C(=O)[O-].OCCOCCO.OCCOCCOCCOCCO.

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

The InChIKey is BSPLTXBAULHMBL-UHFFFAOYSA-J. The full InChI is InChI=1S/C8H18O5.C4H10O3.4C4H6O2/c9-1-3-11-5-7-13-8-6-12-4-2-10;5-1-3-7-4-2-6;4*1-3(2)4(5)6/h9-10H,1-8H2;5-6H,1-4H2;4*1H2,2H3,(H,5,6)/p-4.

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

2-(2-hydroxyethoxy)ethanol;2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethanol;tetrakis(2-methylprop-2-enoate) has a molecular weight of 640.68 g/mol, XLogP of -4.74, 18 rotatable bonds, 4 hydrogen bond donors, and 16 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(2-hydroxyethoxy)ethanol;2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethanol;tetrakis(2-methylprop-2-enoate) is sourced from PubChem (CID 18957552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).