2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]anthracene-9,10-dione

C24H28O8 — CID 22315906

IUPAC2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]anthracene-9,10-dione
SMILESO=C1c2ccccc2C(=O)c2cc(OCCOCCOCCOCCOCCO)ccc21
InChIInChI=1S/C24H28O8/c25-7-8-28-9-10-29-11-12-30-13-14-31-15-16-32-18-5-6-21-22(17-18)24(27)20-4-2-1-3-19(20)23(21)26/h1-6,17,25H,7-16H2
InChIKeyUIWLURSKWXBHMW-UHFFFAOYSA-N
MW444.48 g/mol
LogP1.90
Rot. Bonds15

About 2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]anthracene-9,10-dione

2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]anthracene-9,10-dione (PubChem CID 22315906) has the molecular formula C24H28O8 and a molecular weight of 444.48 g/mol. Its IUPAC name is 2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]anthracene-9,10-dione.

Molecular Properties

Compound Name2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]anthracene-9,10-dione
PubChem CID22315906
Molecular FormulaC24H28O8
Molecular Weight444.48 g/mol
Exact Mass444.18
IUPAC Name2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]anthracene-9,10-dione
SMILESO=C1c2ccccc2C(=O)c2cc(OCCOCCOCCOCCOCCO)ccc21
InChIInChI=1S/C24H28O8/c25-7-8-28-9-10-29-11-12-30-13-14-31-15-16-32-18-5-6-21-22(17-18)24(27)20-4-2-1-3-19(20)23(21)26/h1-6,17,25H,7-16H2
InChIKeyUIWLURSKWXBHMW-UHFFFAOYSA-N
XLogP1.90
TPSA100.52 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds15
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500444.48
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'quinone_A(370)', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]anthracene-9,10-dione?
The IUPAC name of 2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]anthracene-9,10-dione (CID 22315906) is 2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]anthracene-9,10-dione.
What is the SMILES notation for 2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]anthracene-9,10-dione?
The canonical SMILES for 2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]anthracene-9,10-dione is O=C1c2ccccc2C(=O)c2cc(OCCOCCOCCOCCOCCO)ccc21.
What is the InChIKey of 2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]anthracene-9,10-dione?
The InChIKey is UIWLURSKWXBHMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28O8/c25-7-8-28-9-10-29-11-12-30-13-14-31-15-16-32-18-5-6-21-22(17-18)24(27)20-4-2-1-3-19(20)23(21)26/h1-6,17,25H,7-16H2.
What are the key properties of 2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]anthracene-9,10-dione?
2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]anthracene-9,10-dione has a molecular weight of 444.48 g/mol, XLogP of 1.90, 15 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]anthracene-9,10-dione is sourced from PubChem (CID 22315906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).