2-(2-hydroxyethoxy)-3-[2-(2-hydroxyethoxy)ethoxy]propan-1-ol

C9H20O6 — CID 59567842

IUPAC2-(2-hydroxyethoxy)-3-[2-(2-hydroxyethoxy)ethoxy]propan-1-ol
SMILESOCCOCCOCC(CO)OCCO
InChIInChI=1S/C9H20O6/c10-1-3-13-5-6-14-8-9(7-12)15-4-2-11/h9-12H,1-8H2
InChIKeyUDHVUNBMPCVQLY-UHFFFAOYSA-N
MW224.25 g/mol
LogP-1.62
Rot. Bonds11

About 2-(2-hydroxyethoxy)-3-[2-(2-hydroxyethoxy)ethoxy]propan-1-ol

2-(2-hydroxyethoxy)-3-[2-(2-hydroxyethoxy)ethoxy]propan-1-ol (PubChem CID 59567842) has the molecular formula C9H20O6 and a molecular weight of 224.25 g/mol. Its IUPAC name is 2-(2-hydroxyethoxy)-3-[2-(2-hydroxyethoxy)ethoxy]propan-1-ol.

Molecular Properties

Compound Name2-(2-hydroxyethoxy)-3-[2-(2-hydroxyethoxy)ethoxy]propan-1-ol
PubChem CID59567842
Molecular FormulaC9H20O6
Molecular Weight224.25 g/mol
Exact Mass224.13
IUPAC Name2-(2-hydroxyethoxy)-3-[2-(2-hydroxyethoxy)ethoxy]propan-1-ol
SMILESOCCOCCOCC(CO)OCCO
InChIInChI=1S/C9H20O6/c10-1-3-13-5-6-14-8-9(7-12)15-4-2-11/h9-12H,1-8H2
InChIKeyUDHVUNBMPCVQLY-UHFFFAOYSA-N
XLogP-1.62
TPSA88.38 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds11
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.25
LogP ≤ 5-1.62
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of 2-(2-hydroxyethoxy)-3-[2-(2-hydroxyethoxy)ethoxy]propan-1-ol?
The IUPAC name of 2-(2-hydroxyethoxy)-3-[2-(2-hydroxyethoxy)ethoxy]propan-1-ol (CID 59567842) is 2-(2-hydroxyethoxy)-3-[2-(2-hydroxyethoxy)ethoxy]propan-1-ol.
What is the SMILES notation for 2-(2-hydroxyethoxy)-3-[2-(2-hydroxyethoxy)ethoxy]propan-1-ol?
The canonical SMILES for 2-(2-hydroxyethoxy)-3-[2-(2-hydroxyethoxy)ethoxy]propan-1-ol is OCCOCCOCC(CO)OCCO.
What is the InChIKey of 2-(2-hydroxyethoxy)-3-[2-(2-hydroxyethoxy)ethoxy]propan-1-ol?
The InChIKey is UDHVUNBMPCVQLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20O6/c10-1-3-13-5-6-14-8-9(7-12)15-4-2-11/h9-12H,1-8H2.
What are the key properties of 2-(2-hydroxyethoxy)-3-[2-(2-hydroxyethoxy)ethoxy]propan-1-ol?
2-(2-hydroxyethoxy)-3-[2-(2-hydroxyethoxy)ethoxy]propan-1-ol has a molecular weight of 224.25 g/mol, XLogP of -1.62, 11 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydroxyethoxy)-3-[2-(2-hydroxyethoxy)ethoxy]propan-1-ol is sourced from PubChem (CID 59567842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).