ethoxyethane;2-[2-(2-hydroxyethoxy)ethoxy]ethanol;methoxymethane

C12H30O6 — CID 18993831

IUPACethoxyethane;2-[2-(2-hydroxyethoxy)ethoxy]ethanol;methoxymethane
SMILESCCOCC.COC.OCCOCCOCCO
InChIInChI=1S/C6H14O4.C4H10O.C2H6O/c7-1-3-9-5-6-10-4-2-8;1-3-5-4-2;1-3-2/h7-8H,1-6H2;3-4H2,1-2H3;1-2H3
InChIKeyKZMCWSHTEBNCBU-UHFFFAOYSA-N
MW270.37 g/mol
LogP0.31
Rot. Bonds9

About ethoxyethane;2-[2-(2-hydroxyethoxy)ethoxy]ethanol;methoxymethane

ethoxyethane;2-[2-(2-hydroxyethoxy)ethoxy]ethanol;methoxymethane (PubChem CID 18993831) has the molecular formula C12H30O6 and a molecular weight of 270.37 g/mol. Its IUPAC name is ethoxyethane;2-[2-(2-hydroxyethoxy)ethoxy]ethanol;methoxymethane.

Molecular Properties

Compound Nameethoxyethane;2-[2-(2-hydroxyethoxy)ethoxy]ethanol;methoxymethane
PubChem CID18993831
Molecular FormulaC12H30O6
Molecular Weight270.37 g/mol
Exact Mass270.20
IUPAC Nameethoxyethane;2-[2-(2-hydroxyethoxy)ethoxy]ethanol;methoxymethane
SMILESCCOCC.COC.OCCOCCOCCO
InChIInChI=1S/C6H14O4.C4H10O.C2H6O/c7-1-3-9-5-6-10-4-2-8;1-3-5-4-2;1-3-2/h7-8H,1-6H2;3-4H2,1-2H3;1-2H3
InChIKeyKZMCWSHTEBNCBU-UHFFFAOYSA-N
XLogP0.31
TPSA77.38 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.37
LogP ≤ 50.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of ethoxyethane;2-[2-(2-hydroxyethoxy)ethoxy]ethanol;methoxymethane?
The IUPAC name of ethoxyethane;2-[2-(2-hydroxyethoxy)ethoxy]ethanol;methoxymethane (CID 18993831) is ethoxyethane;2-[2-(2-hydroxyethoxy)ethoxy]ethanol;methoxymethane.
What is the SMILES notation for ethoxyethane;2-[2-(2-hydroxyethoxy)ethoxy]ethanol;methoxymethane?
The canonical SMILES for ethoxyethane;2-[2-(2-hydroxyethoxy)ethoxy]ethanol;methoxymethane is CCOCC.COC.OCCOCCOCCO.
What is the InChIKey of ethoxyethane;2-[2-(2-hydroxyethoxy)ethoxy]ethanol;methoxymethane?
The InChIKey is KZMCWSHTEBNCBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14O4.C4H10O.C2H6O/c7-1-3-9-5-6-10-4-2-8;1-3-5-4-2;1-3-2/h7-8H,1-6H2;3-4H2,1-2H3;1-2H3.
What are the key properties of ethoxyethane;2-[2-(2-hydroxyethoxy)ethoxy]ethanol;methoxymethane?
ethoxyethane;2-[2-(2-hydroxyethoxy)ethoxy]ethanol;methoxymethane has a molecular weight of 270.37 g/mol, XLogP of 0.31, 9 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for ethoxyethane;2-[2-(2-hydroxyethoxy)ethoxy]ethanol;methoxymethane is sourced from PubChem (CID 18993831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).