2-(2,2-diethoxy-2-methoxyethoxy)ethanol

C9H20O5 — CID 173193032

IUPAC2-(2,2-diethoxy-2-methoxyethoxy)ethanol
SMILESCCOC(COCCO)(OC)OCC
InChIInChI=1S/C9H20O5/c1-4-13-9(11-3,14-5-2)8-12-7-6-10/h10H,4-8H2,1-3H3
InChIKeyYQPXACHVDSWKRQ-UHFFFAOYSA-N
MW208.25 g/mol
LogP0.37
Rot. Bonds9

About 2-(2,2-diethoxy-2-methoxyethoxy)ethanol

2-(2,2-diethoxy-2-methoxyethoxy)ethanol (PubChem CID 173193032) has the molecular formula C9H20O5 and a molecular weight of 208.25 g/mol. Its IUPAC name is 2-(2,2-diethoxy-2-methoxyethoxy)ethanol.

Molecular Properties

Compound Name2-(2,2-diethoxy-2-methoxyethoxy)ethanol
PubChem CID173193032
Molecular FormulaC9H20O5
Molecular Weight208.25 g/mol
Exact Mass208.13
IUPAC Name2-(2,2-diethoxy-2-methoxyethoxy)ethanol
SMILESCCOC(COCCO)(OC)OCC
InChIInChI=1S/C9H20O5/c1-4-13-9(11-3,14-5-2)8-12-7-6-10/h10H,4-8H2,1-3H3
InChIKeyYQPXACHVDSWKRQ-UHFFFAOYSA-N
XLogP0.37
TPSA57.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.25
LogP ≤ 50.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

1-(2,2,2-triethoxyethoxy)propane
CID 10751414
2-ethoxy-1-(2-ethoxyethoxy)-2-methylpropane;2-(2-hydroxyethoxy)ethanol
CID 161457793
2,2-dimethoxypropan-1-ol;2-(2,2-dimethoxypropoxy)ethanol
CID 160953059
ethoxyethane;2-[2-(2-hydroxyethoxy)ethoxy]ethanol;methoxymethane
CID 18993831
2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]-1,1-dimethoxyethanol
CID 87213515
2-[2-(2-methoxy-2-methylpropoxy)ethoxy]ethanol
CID 174420073
2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-1,1-dimethoxyethanol
CID 140726713
ethane-1,2-diol;2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethanol;methoxymethane
CID 23133360
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
1-[2-(2,2,2-triethoxyethoxy)ethoxy]butane
CID 150976644
2-(2-ethoxyethoxy)ethanol;methanol
CID 87987109

Frequently Asked Questions

What is the IUPAC name of 2-(2,2-diethoxy-2-methoxyethoxy)ethanol?
The IUPAC name of 2-(2,2-diethoxy-2-methoxyethoxy)ethanol (CID 173193032) is 2-(2,2-diethoxy-2-methoxyethoxy)ethanol.
What is the SMILES notation for 2-(2,2-diethoxy-2-methoxyethoxy)ethanol?
The canonical SMILES for 2-(2,2-diethoxy-2-methoxyethoxy)ethanol is CCOC(COCCO)(OC)OCC.
What is the InChIKey of 2-(2,2-diethoxy-2-methoxyethoxy)ethanol?
The InChIKey is YQPXACHVDSWKRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20O5/c1-4-13-9(11-3,14-5-2)8-12-7-6-10/h10H,4-8H2,1-3H3.
What are the key properties of 2-(2,2-diethoxy-2-methoxyethoxy)ethanol?
2-(2,2-diethoxy-2-methoxyethoxy)ethanol has a molecular weight of 208.25 g/mol, XLogP of 0.37, 9 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,2-diethoxy-2-methoxyethoxy)ethanol is sourced from PubChem (CID 173193032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).