ethanol;1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane

C12H28O6 — CID 87301416

IUPACethanol;1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane
SMILESCCO.COCCOCCOCCOCCOC
InChIInChI=1S/C10H22O5.C2H6O/c1-11-3-5-13-7-9-15-10-8-14-6-4-12-2;1-2-3/h3-10H2,1-2H3;3H,2H2,1H3
InChIKeyKJIZWBHGYGMDES-UHFFFAOYSA-N
MW268.35 g/mol
LogP0.33
Rot. Bonds12

About ethanol;1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane

ethanol;1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane (PubChem CID 87301416) has the molecular formula C12H28O6 and a molecular weight of 268.35 g/mol. Its IUPAC name is ethanol;1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane.

Molecular Properties

Compound Nameethanol;1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane
PubChem CID87301416
Molecular FormulaC12H28O6
Molecular Weight268.35 g/mol
Exact Mass268.19
IUPAC Nameethanol;1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane
SMILESCCO.COCCOCCOCCOCCOC
InChIInChI=1S/C10H22O5.C2H6O/c1-11-3-5-13-7-9-15-10-8-14-6-4-12-2;1-2-3/h3-10H2,1-2H3;3H,2H2,1H3
InChIKeyKJIZWBHGYGMDES-UHFFFAOYSA-N
XLogP0.33
TPSA66.38 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds12
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.35
LogP ≤ 50.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane
CID 87439194
1-methoxy-2-[2-(2-methoxyethoxy)ethoxy]ethane
CID 8189
1,2-dimethoxyethane;1-methoxy-2-(2-methoxyethoxy)ethane;1-methoxy-2-[2-(2-methoxyethoxy)ethoxy]ethane;1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane
CID 159847962
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
lithium bis(1-methoxy-2-(2-methoxyethoxy)ethane)
CID 5257331
CID 172826348
CID 172826348
1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane;neodymium
CID 161321430
CID 173303266
CID 173303266
1-methoxy-2-(2-methoxyethoxy)ethane;tellane
CID 175355772
sodium;ethane-1,2-diol;1-methoxy-2-(2-methoxyethoxy)ethane;hydroxide
CID 173220680
2-methoxyethanol;2-(2-methoxyethoxy)ethanol
CID 87975598

Frequently Asked Questions

What is the IUPAC name of ethanol;1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane?
The IUPAC name of ethanol;1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane (CID 87301416) is ethanol;1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane.
What is the SMILES notation for ethanol;1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane?
The canonical SMILES for ethanol;1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane is CCO.COCCOCCOCCOCCOC.
What is the InChIKey of ethanol;1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane?
The InChIKey is KJIZWBHGYGMDES-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22O5.C2H6O/c1-11-3-5-13-7-9-15-10-8-14-6-4-12-2;1-2-3/h3-10H2,1-2H3;3H,2H2,1H3.
What are the key properties of ethanol;1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane?
ethanol;1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane has a molecular weight of 268.35 g/mol, XLogP of 0.33, 12 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for ethanol;1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane is sourced from PubChem (CID 87301416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).