triethyl-[2-(2-methoxyethoxy)ethyl]azanium tetrafluoroborate

C11H26BF4NO2 — CID 87737614

IUPACtriethyl-[2-(2-methoxyethoxy)ethyl]azanium tetrafluoroborate
SMILESCC[N+](CC)(CC)CCOCCOC.F[B-](F)(F)F
InChIInChI=1S/C11H26NO2.BF4/c1-5-12(6-2,7-3)8-9-14-11-10-13-4;2-1(3,4)5/h5-11H2,1-4H3;/q+1;-1
InChIKeyXMEIPGXQHCOXKL-UHFFFAOYSA-N
MW291.14 g/mol
LogP2.83
Rot. Bonds9

About triethyl-[2-(2-methoxyethoxy)ethyl]azanium tetrafluoroborate

triethyl-[2-(2-methoxyethoxy)ethyl]azanium tetrafluoroborate (PubChem CID 87737614) has the molecular formula C11H26BF4NO2 and a molecular weight of 291.14 g/mol. Its IUPAC name is triethyl-[2-(2-methoxyethoxy)ethyl]azanium tetrafluoroborate.

Molecular Properties

Compound Nametriethyl-[2-(2-methoxyethoxy)ethyl]azanium tetrafluoroborate
PubChem CID87737614
Molecular FormulaC11H26BF4NO2
Molecular Weight291.14 g/mol
Exact Mass291.20
IUPAC Nametriethyl-[2-(2-methoxyethoxy)ethyl]azanium tetrafluoroborate
SMILESCC[N+](CC)(CC)CCOCCOC.F[B-](F)(F)F
InChIInChI=1S/C11H26NO2.BF4/c1-5-12(6-2,7-3)8-9-14-11-10-13-4;2-1(3,4)5/h5-11H2,1-4H3;/q+1;-1
InChIKeyXMEIPGXQHCOXKL-UHFFFAOYSA-N
XLogP2.83
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.14
LogP ≤ 52.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_2', 'substructure': 'N/A'}

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Related Compounds

triethyl-[3-[2-(2-methoxyethoxy)ethoxy]propyl]azanium
CID 135364479
triethyl(2-methoxyethyl)azanium
CID 3026728
diethyl-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]-methylazanium
CID 90306950
triethyl-[2-(2-propoxyethoxy)ethyl]azanium
CID 88980838
tris[2-(2-methoxyethoxy)ethyl]-propylazanium;trihydrobromide
CID 173388150
diethyl-[2-(2-methoxyethoxy)ethyl]-methylazanium chloride
CID 167445594
1-methoxy-2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethane
CID 140812368
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-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane
CID 87439194
1-methoxy-2-[2-(2-methoxyethoxy)ethoxy]ethane
CID 8189
bis[2-(2-methoxyethoxy)ethyl]-dimethylazanium chloride
CID 129073269
trifluoro-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxymethyl]boranuide
CID 140702553

Frequently Asked Questions

What is the IUPAC name of triethyl-[2-(2-methoxyethoxy)ethyl]azanium tetrafluoroborate?
The IUPAC name of triethyl-[2-(2-methoxyethoxy)ethyl]azanium tetrafluoroborate (CID 87737614) is triethyl-[2-(2-methoxyethoxy)ethyl]azanium tetrafluoroborate.
What is the SMILES notation for triethyl-[2-(2-methoxyethoxy)ethyl]azanium tetrafluoroborate?
The canonical SMILES for triethyl-[2-(2-methoxyethoxy)ethyl]azanium tetrafluoroborate is CC[N+](CC)(CC)CCOCCOC.F[B-](F)(F)F.
What is the InChIKey of triethyl-[2-(2-methoxyethoxy)ethyl]azanium tetrafluoroborate?
The InChIKey is XMEIPGXQHCOXKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H26NO2.BF4/c1-5-12(6-2,7-3)8-9-14-11-10-13-4;2-1(3,4)5/h5-11H2,1-4H3;/q+1;-1.
What are the key properties of triethyl-[2-(2-methoxyethoxy)ethyl]azanium tetrafluoroborate?
triethyl-[2-(2-methoxyethoxy)ethyl]azanium tetrafluoroborate has a molecular weight of 291.14 g/mol, XLogP of 2.83, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for triethyl-[2-(2-methoxyethoxy)ethyl]azanium tetrafluoroborate is sourced from PubChem (CID 87737614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).