2-(2-hydroxyethoxy)ethanol;dihydrate

C4H14O5 — CID 22572092

IUPAC2-(2-hydroxyethoxy)ethanol;dihydrate
SMILESO.O.OCCOCCO
InChIInChI=1S/C4H10O3.2H2O/c5-1-3-7-4-2-6;;/h5-6H,1-4H2;2*1H2
InChIKeyNJWAYDPFSGPKLL-UHFFFAOYSA-N
MW142.15 g/mol
LogP-2.66
Rot. Bonds4

About 2-(2-hydroxyethoxy)ethanol;dihydrate

2-(2-hydroxyethoxy)ethanol;dihydrate (PubChem CID 22572092) has the molecular formula C4H14O5 and a molecular weight of 142.15 g/mol. Its IUPAC name is 2-(2-hydroxyethoxy)ethanol;dihydrate.

Molecular Properties

Compound Name2-(2-hydroxyethoxy)ethanol;dihydrate
PubChem CID22572092
Molecular FormulaC4H14O5
Molecular Weight142.15 g/mol
Exact Mass142.08
IUPAC Name2-(2-hydroxyethoxy)ethanol;dihydrate
SMILESO.O.OCCOCCO
InChIInChI=1S/C4H10O3.2H2O/c5-1-3-7-4-2-6;;/h5-6H,1-4H2;2*1H2
InChIKeyNJWAYDPFSGPKLL-UHFFFAOYSA-N
XLogP-2.66
TPSA112.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.15
LogP ≤ 5-2.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 17472
2-[2-[2-[2-[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]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 14619695
CID 159345993
CID 159345993
2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[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]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 14619703
magnesium;hydride;2-(2-hydroxyethoxy)ethanol
CID 175108032
deuteriomethane;2-(2-hydroxyethoxy)ethanol
CID 86287438
ethane;2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethanol
CID 159638520
2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[3-[3-[3-[3-[3-[3-[3-[3-[3-[3-[3-[3-[3-[3-[3-[3-[3-[3-[3-[3-[3-[3-[3-[3-[3-[3-[3-[3-[3-[3-[3-[3-[3-[3-[3-[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]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 175701679
2-[8-(2-hydroxyethoxy)octoxy]ethanol
CID 174919525
2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxymethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 123262216
2-(2-fluoroethoxy)ethanol
CID 9763
bis(2-(2-ethoxyethoxy)ethanol);hydrate
CID 87793690

Frequently Asked Questions

What is the IUPAC name of 2-(2-hydroxyethoxy)ethanol;dihydrate?
The IUPAC name of 2-(2-hydroxyethoxy)ethanol;dihydrate (CID 22572092) is 2-(2-hydroxyethoxy)ethanol;dihydrate.
What is the SMILES notation for 2-(2-hydroxyethoxy)ethanol;dihydrate?
The canonical SMILES for 2-(2-hydroxyethoxy)ethanol;dihydrate is O.O.OCCOCCO.
What is the InChIKey of 2-(2-hydroxyethoxy)ethanol;dihydrate?
The InChIKey is NJWAYDPFSGPKLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10O3.2H2O/c5-1-3-7-4-2-6;;/h5-6H,1-4H2;2*1H2.
What are the key properties of 2-(2-hydroxyethoxy)ethanol;dihydrate?
2-(2-hydroxyethoxy)ethanol;dihydrate has a molecular weight of 142.15 g/mol, XLogP of -2.66, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydroxyethoxy)ethanol;dihydrate is sourced from PubChem (CID 22572092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).