ethoxyethane;2-(2-hydroxyethoxy)ethanol;2-(2-methoxyethoxy)ethanol

C13H32O7 — CID 138488183

IUPACethoxyethane;2-(2-hydroxyethoxy)ethanol;2-(2-methoxyethoxy)ethanol
SMILESCCOCC.COCCOCCO.OCCOCCO
InChIInChI=1S/C5H12O3.C4H10O3.C4H10O/c1-7-4-5-8-3-2-6;5-1-3-7-4-2-6;1-3-5-4-2/h6H,2-5H2,1H3;5-6H,1-4H2;3-4H2,1-2H3
InChIKeyMMBXXRQJWJFGKH-UHFFFAOYSA-N
MW300.39 g/mol
LogP-0.33
Rot. Bonds11

About ethoxyethane;2-(2-hydroxyethoxy)ethanol;2-(2-methoxyethoxy)ethanol

ethoxyethane;2-(2-hydroxyethoxy)ethanol;2-(2-methoxyethoxy)ethanol (PubChem CID 138488183) has the molecular formula C13H32O7 and a molecular weight of 300.39 g/mol. Its IUPAC name is ethoxyethane;2-(2-hydroxyethoxy)ethanol;2-(2-methoxyethoxy)ethanol.

Molecular Properties

Compound Nameethoxyethane;2-(2-hydroxyethoxy)ethanol;2-(2-methoxyethoxy)ethanol
PubChem CID138488183
Molecular FormulaC13H32O7
Molecular Weight300.39 g/mol
Exact Mass300.21
IUPAC Nameethoxyethane;2-(2-hydroxyethoxy)ethanol;2-(2-methoxyethoxy)ethanol
SMILESCCOCC.COCCOCCO.OCCOCCO
InChIInChI=1S/C5H12O3.C4H10O3.C4H10O/c1-7-4-5-8-3-2-6;5-1-3-7-4-2-6;1-3-5-4-2/h6H,2-5H2,1H3;5-6H,1-4H2;3-4H2,1-2H3
InChIKeyMMBXXRQJWJFGKH-UHFFFAOYSA-N
XLogP-0.33
TPSA97.61 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds11
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.39
LogP ≤ 5-0.33
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

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Related Compounds

2-(2-hydroxyethoxy)ethanol;methoxyethane;2-[2-(2-methoxyethoxy)ethoxy]ethanol
CID 175424944
2-(2-hydroxyethoxy)ethanol;methoxyethane;1-methoxy-2-(2-methoxyethoxy)ethane
CID 174794611
ethoxyethane;2-[2-(2-hydroxyethoxy)ethoxy]ethanol;methoxymethane
CID 18993831
2-methoxyethanol;2-(2-methoxyethoxy)ethanol
CID 87975598
2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethanol;hydroiodide
CID 88616948
2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethanol;1-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]propane
CID 161348551
diethyl carbonate;2-[2-(2-hydroxyethoxy)ethoxy]ethanol;1-methoxy-2-(2-methoxyethoxy)ethane
CID 174866576
ethane-1,2-diol;2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethanol;methoxymethane
CID 23133360
ethoxyethane;2-(2-hydroxyethoxy)ethanol;propan-2-one
CID 146319223
ethane-1,2-diol;2-methoxyethanol;1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane
CID 161198801
bis(2-(2-ethoxyethoxy)ethanol);hydrate
CID 87793690
2-(2-ethoxyethoxy)ethanol;methanol
CID 87987109

Frequently Asked Questions

What is the IUPAC name of ethoxyethane;2-(2-hydroxyethoxy)ethanol;2-(2-methoxyethoxy)ethanol?
The IUPAC name of ethoxyethane;2-(2-hydroxyethoxy)ethanol;2-(2-methoxyethoxy)ethanol (CID 138488183) is ethoxyethane;2-(2-hydroxyethoxy)ethanol;2-(2-methoxyethoxy)ethanol.
What is the SMILES notation for ethoxyethane;2-(2-hydroxyethoxy)ethanol;2-(2-methoxyethoxy)ethanol?
The canonical SMILES for ethoxyethane;2-(2-hydroxyethoxy)ethanol;2-(2-methoxyethoxy)ethanol is CCOCC.COCCOCCO.OCCOCCO.
What is the InChIKey of ethoxyethane;2-(2-hydroxyethoxy)ethanol;2-(2-methoxyethoxy)ethanol?
The InChIKey is MMBXXRQJWJFGKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12O3.C4H10O3.C4H10O/c1-7-4-5-8-3-2-6;5-1-3-7-4-2-6;1-3-5-4-2/h6H,2-5H2,1H3;5-6H,1-4H2;3-4H2,1-2H3.
What are the key properties of ethoxyethane;2-(2-hydroxyethoxy)ethanol;2-(2-methoxyethoxy)ethanol?
ethoxyethane;2-(2-hydroxyethoxy)ethanol;2-(2-methoxyethoxy)ethanol has a molecular weight of 300.39 g/mol, XLogP of -0.33, 11 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for ethoxyethane;2-(2-hydroxyethoxy)ethanol;2-(2-methoxyethoxy)ethanol is sourced from PubChem (CID 138488183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).