triethyl(octyl)azanium hydroxide

C14H33NO — CID 23496315

IUPACtriethyl(octyl)azanium hydroxide
SMILESCCCCCCCC[N+](CC)(CC)CC.[OH-]
InChIInChI=1S/C14H32N.H2O/c1-5-9-10-11-12-13-14-15(6-2,7-3)8-4;/h5-14H2,1-4H3;1H2/q+1;/p-1
InChIKeyIXLWLNRYFMSSSK-UHFFFAOYSA-M
MW231.42 g/mol
LogP4.05
Rot. Bonds10

About triethyl(octyl)azanium hydroxide

triethyl(octyl)azanium hydroxide (PubChem CID 23496315) has the molecular formula C14H33NO and a molecular weight of 231.42 g/mol. Its IUPAC name is triethyl(octyl)azanium hydroxide.

Molecular Properties

Compound Nametriethyl(octyl)azanium hydroxide
PubChem CID23496315
Molecular FormulaC14H33NO
Molecular Weight231.42 g/mol
Exact Mass231.26
IUPAC Nametriethyl(octyl)azanium hydroxide
SMILESCCCCCCCC[N+](CC)(CC)CC.[OH-]
InChIInChI=1S/C14H32N.H2O/c1-5-9-10-11-12-13-14-15(6-2,7-3)8-4;/h5-14H2,1-4H3;1H2/q+1;/p-1
InChIKeyIXLWLNRYFMSSSK-UHFFFAOYSA-M
XLogP4.05
TPSA30.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.42
LogP ≤ 54.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

triethyl(tetradecyl)azanium
CID 28911
triethyl(tetradecyl)azanium chloride
CID 15664048
triethyl(hexadecyl)azanium iodide
CID 18466277
triethyl(tetracosyl)azanium bromide
CID 153322859
triethyl(icosyl)azanium chloride
CID 141198165
triethyl(tetradecyl)azanium iodide
CID 87777336
triethyl(tridecyl)azanium bromide
CID 14647396
docosyl(triethyl)azanium bromide
CID 71358281
docosyl(triethyl)azanium chloride
CID 42638705
didodecyl(diethyl)azanium hydroxide
CID 87834319
azane;dodecyl(triethyl)azanium;hydrochloride
CID 174746836
didecyl-ethyl-octylazanium
CID 172694602

Frequently Asked Questions

What is the IUPAC name of triethyl(octyl)azanium hydroxide?
The IUPAC name of triethyl(octyl)azanium hydroxide (CID 23496315) is triethyl(octyl)azanium hydroxide.
What is the SMILES notation for triethyl(octyl)azanium hydroxide?
The canonical SMILES for triethyl(octyl)azanium hydroxide is CCCCCCCC[N+](CC)(CC)CC.[OH-].
What is the InChIKey of triethyl(octyl)azanium hydroxide?
The InChIKey is IXLWLNRYFMSSSK-UHFFFAOYSA-M. The full InChI is InChI=1S/C14H32N.H2O/c1-5-9-10-11-12-13-14-15(6-2,7-3)8-4;/h5-14H2,1-4H3;1H2/q+1;/p-1.
What are the key properties of triethyl(octyl)azanium hydroxide?
triethyl(octyl)azanium hydroxide has a molecular weight of 231.42 g/mol, XLogP of 4.05, 10 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for triethyl(octyl)azanium hydroxide is sourced from PubChem (CID 23496315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).