gold(3+);tetrabutylazanium;tetrachloride

C16H36AuCl4N — CID 25141921

IUPACgold(3+);tetrabutylazanium;tetrachloride
SMILESCCCC[N+](CCCC)(CCCC)CCCC.[Au+3].[Cl-].[Cl-].[Cl-].[Cl-]
InChIInChI=1S/C16H36N.Au.4ClH/c1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;;;;;/h5-16H2,1-4H3;;4*1H/q+1;+3;;;;/p-4
InChIKeyYAOXYADITCJWPJ-UHFFFAOYSA-J
MW581.25 g/mol
LogP-6.98
Rot. Bonds12

About gold(3+);tetrabutylazanium;tetrachloride

gold(3+);tetrabutylazanium;tetrachloride (PubChem CID 25141921) has the molecular formula C16H36AuCl4N and a molecular weight of 581.25 g/mol. Its IUPAC name is gold(3+);tetrabutylazanium;tetrachloride.

Molecular Properties

Compound Namegold(3+);tetrabutylazanium;tetrachloride
PubChem CID25141921
Molecular FormulaC16H36AuCl4N
Molecular Weight581.25 g/mol
Exact Mass579.13
IUPAC Namegold(3+);tetrabutylazanium;tetrachloride
SMILESCCCC[N+](CCCC)(CCCC)CCCC.[Au+3].[Cl-].[Cl-].[Cl-].[Cl-]
InChIInChI=1S/C16H36N.Au.4ClH/c1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;;;;;/h5-16H2,1-4H3;;4*1H/q+1;+3;;;;/p-4
InChIKeyYAOXYADITCJWPJ-UHFFFAOYSA-J
XLogP-6.98
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds12
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500581.25
LogP ≤ 5-6.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

bis(palladium(2+));bis(tetrabutylazanium);hexachloride
CID 51000427
tetrabutylazanium;chloride;hydrobromide
CID 160850218
iron;tetrabutylazanium;chloride
CID 157427266
dibutyl(dihexadecyl)azanium chloride
CID 87778770
tetrabutylazanium;pentahydrate
CID 173386676
tetrabutylazanium hydroxide
CID 2723671
dodecane;tetrabutylazanium
CID 173225937
butyl(tripentyl)azanium
CID 14022644
ethanol;tetrabutylazanium;chloride
CID 175552872
butyl-dipentyl-propylazanium chloride
CID 88839521
tributyl(triacontyl)azanium
CID 153322884
potassium;tetrabutylazanium;diiodide
CID 144841578

Frequently Asked Questions

What is the IUPAC name of gold(3+);tetrabutylazanium;tetrachloride?
The IUPAC name of gold(3+);tetrabutylazanium;tetrachloride (CID 25141921) is gold(3+);tetrabutylazanium;tetrachloride.
What is the SMILES notation for gold(3+);tetrabutylazanium;tetrachloride?
The canonical SMILES for gold(3+);tetrabutylazanium;tetrachloride is CCCC[N+](CCCC)(CCCC)CCCC.[Au+3].[Cl-].[Cl-].[Cl-].[Cl-].
What is the InChIKey of gold(3+);tetrabutylazanium;tetrachloride?
The InChIKey is YAOXYADITCJWPJ-UHFFFAOYSA-J. The full InChI is InChI=1S/C16H36N.Au.4ClH/c1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;;;;;/h5-16H2,1-4H3;;4*1H/q+1;+3;;;;/p-4.
What are the key properties of gold(3+);tetrabutylazanium;tetrachloride?
gold(3+);tetrabutylazanium;tetrachloride has a molecular weight of 581.25 g/mol, XLogP of -6.98, 12 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for gold(3+);tetrabutylazanium;tetrachloride is sourced from PubChem (CID 25141921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).