2-(2-hydroxyethoxy)ethanol;hexakis(prop-2-enoic acid)

C22H34O15 — CID 161223084

IUPAC2-(2-hydroxyethoxy)ethanol;hexakis(prop-2-enoic acid)
SMILESC=CC(=O)O.C=CC(=O)O.C=CC(=O)O.C=CC(=O)O.C=CC(=O)O.C=CC(=O)O.OCCOCCO
InChIInChI=1S/C4H10O3.6C3H4O2/c5-1-3-7-4-2-6;6*1-2-3(4)5/h5-6H,1-4H2;6*2H,1H2,(H,4,5)
InChIKeyUXTRNZRECFHSOI-UHFFFAOYSA-N
MW538.50 g/mol
LogP0.53
Rot. Bonds10

About 2-(2-hydroxyethoxy)ethanol;hexakis(prop-2-enoic acid)

2-(2-hydroxyethoxy)ethanol;hexakis(prop-2-enoic acid) (PubChem CID 161223084) has the molecular formula C22H34O15 and a molecular weight of 538.50 g/mol. Its IUPAC name is 2-(2-hydroxyethoxy)ethanol;hexakis(prop-2-enoic acid).

Molecular Properties

Compound Name2-(2-hydroxyethoxy)ethanol;hexakis(prop-2-enoic acid)
PubChem CID161223084
Molecular FormulaC22H34O15
Molecular Weight538.50 g/mol
Exact Mass538.19
IUPAC Name2-(2-hydroxyethoxy)ethanol;hexakis(prop-2-enoic acid)
SMILESC=CC(=O)O.C=CC(=O)O.C=CC(=O)O.C=CC(=O)O.C=CC(=O)O.C=CC(=O)O.OCCOCCO
InChIInChI=1S/C4H10O3.6C3H4O2/c5-1-3-7-4-2-6;6*1-2-3(4)5/h5-6H,1-4H2;6*2H,1H2,(H,4,5)
InChIKeyUXTRNZRECFHSOI-UHFFFAOYSA-N
XLogP0.53
TPSA273.49 Ų
H-Bond Donors8
H-Bond Acceptors9
Rotatable Bonds10
Heavy Atoms37
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500538.50
LogP ≤ 50.53
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

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

Analyze 2-(2-hydroxyethoxy)ethanol;hexakis(prop-2-enoic acid) with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

tris(2-(2-hydroxyethoxy)ethanol);prop-2-enoic acid
CID 173161681
2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol;prop-2-enoic acid
CID 88626214
2-[2-(2-butoxyethoxy)ethoxy]ethanol;prop-2-enoic acid
CID 174828919
2-(2-hydroxyethoxy)ethanol;bis(prop-2-enoic acid);terephthalic acid
CID 175831350
dodecakis(ethane-1,2-diol);tridecakis(prop-2-enoic acid)
CID 173073218
ethane-1,2-diol;tetrakis(prop-2-enoic acid)
CID 157215005
bis(butane-1,1-diol);2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethanol;bis(prop-2-enoic acid)
CID 158001200
2-[2-[2-[2-[2-(2-phenoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethanol;prop-2-enoic acid
CID 162233537
2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-1-methoxyethanol;prop-2-enoic acid
CID 87255416
2-methoxyethanol;prop-2-enoic acid;titanium
CID 22899396
2-[2-(2-hydroxyethoxy)ethoxy]-2-methoxyethanol;prop-2-enoic acid
CID 159030949
2-(oxiran-2-ylmethoxy)ethanol;prop-2-enoic acid
CID 158133207

Frequently Asked Questions

What is the IUPAC name of 2-(2-hydroxyethoxy)ethanol;hexakis(prop-2-enoic acid)?
The IUPAC name of 2-(2-hydroxyethoxy)ethanol;hexakis(prop-2-enoic acid) (CID 161223084) is 2-(2-hydroxyethoxy)ethanol;hexakis(prop-2-enoic acid).
What is the SMILES notation for 2-(2-hydroxyethoxy)ethanol;hexakis(prop-2-enoic acid)?
The canonical SMILES for 2-(2-hydroxyethoxy)ethanol;hexakis(prop-2-enoic acid) is C=CC(=O)O.C=CC(=O)O.C=CC(=O)O.C=CC(=O)O.C=CC(=O)O.C=CC(=O)O.OCCOCCO.
What is the InChIKey of 2-(2-hydroxyethoxy)ethanol;hexakis(prop-2-enoic acid)?
The InChIKey is UXTRNZRECFHSOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10O3.6C3H4O2/c5-1-3-7-4-2-6;6*1-2-3(4)5/h5-6H,1-4H2;6*2H,1H2,(H,4,5).
What are the key properties of 2-(2-hydroxyethoxy)ethanol;hexakis(prop-2-enoic acid)?
2-(2-hydroxyethoxy)ethanol;hexakis(prop-2-enoic acid) has a molecular weight of 538.50 g/mol, XLogP of 0.53, 10 rotatable bonds, 8 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydroxyethoxy)ethanol;hexakis(prop-2-enoic acid) is sourced from PubChem (CID 161223084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).