lithium;butane;1-methoxy-2-(2-methoxyethoxy)ethane

C10H23LiO3 — CID 88751821

IUPAClithium;butane;1-methoxy-2-(2-methoxyethoxy)ethane
SMILESCOCCOCCOC.[CH2-]CCC.[Li+]
InChIInChI=1S/C6H14O3.C4H9.Li/c1-7-3-5-9-6-4-8-2;1-3-4-2;/h3-6H2,1-2H3;1,3-4H2,2H3;/q;-1;+1
InChIKeyMYXUSUWHKNZDFF-UHFFFAOYSA-N
MW198.23 g/mol
LogP-1.08
Rot. Bonds7

About lithium;butane;1-methoxy-2-(2-methoxyethoxy)ethane

lithium;butane;1-methoxy-2-(2-methoxyethoxy)ethane (PubChem CID 88751821) has the molecular formula C10H23LiO3 and a molecular weight of 198.23 g/mol. Its IUPAC name is lithium;butane;1-methoxy-2-(2-methoxyethoxy)ethane.

Molecular Properties

Compound Namelithium;butane;1-methoxy-2-(2-methoxyethoxy)ethane
PubChem CID88751821
Molecular FormulaC10H23LiO3
Molecular Weight198.23 g/mol
Exact Mass198.18
IUPAC Namelithium;butane;1-methoxy-2-(2-methoxyethoxy)ethane
SMILESCOCCOCCOC.[CH2-]CCC.[Li+]
InChIInChI=1S/C6H14O3.C4H9.Li/c1-7-3-5-9-6-4-8-2;1-3-4-2;/h3-6H2,1-2H3;1,3-4H2,2H3;/q;-1;+1
InChIKeyMYXUSUWHKNZDFF-UHFFFAOYSA-N
XLogP-1.08
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.23
LogP ≤ 5-1.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

lithium bis(1-methoxy-2-(2-methoxyethoxy)ethane)
CID 5257331
1-methoxy-2-(2-methoxyethoxy)ethane;1-propoxypropane
CID 160614249
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
1-methoxy-2-(2-methoxyethoxy)ethane;tellane
CID 175355772
1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane;neodymium
CID 161321430
CID 173303266
CID 173303266
CID 172826348
CID 172826348
ethanol;1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane
CID 87301416
1-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]-2-methoxyethane
CID 19982973
1,2-dimethoxyethane;1-ethoxy-2-(2-ethoxyethoxy)ethane
CID 159445382

Frequently Asked Questions

What is the IUPAC name of lithium;butane;1-methoxy-2-(2-methoxyethoxy)ethane?
The IUPAC name of lithium;butane;1-methoxy-2-(2-methoxyethoxy)ethane (CID 88751821) is lithium;butane;1-methoxy-2-(2-methoxyethoxy)ethane.
What is the SMILES notation for lithium;butane;1-methoxy-2-(2-methoxyethoxy)ethane?
The canonical SMILES for lithium;butane;1-methoxy-2-(2-methoxyethoxy)ethane is COCCOCCOC.[CH2-]CCC.[Li+].
What is the InChIKey of lithium;butane;1-methoxy-2-(2-methoxyethoxy)ethane?
The InChIKey is MYXUSUWHKNZDFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14O3.C4H9.Li/c1-7-3-5-9-6-4-8-2;1-3-4-2;/h3-6H2,1-2H3;1,3-4H2,2H3;/q;-1;+1.
What are the key properties of lithium;butane;1-methoxy-2-(2-methoxyethoxy)ethane?
lithium;butane;1-methoxy-2-(2-methoxyethoxy)ethane has a molecular weight of 198.23 g/mol, XLogP of -1.08, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for lithium;butane;1-methoxy-2-(2-methoxyethoxy)ethane is sourced from PubChem (CID 88751821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).