hexasodium;tris(methyl-dioxido-oxo-λ5-arsane)

C3H9As3Na6O9 — CID 173326261

IUPAChexasodium;tris(methyl-dioxido-oxo-λ5-arsane)
SMILESC[As](=O)([O-])[O-].C[As](=O)([O-])[O-].C[As](=O)([O-])[O-].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]
InChIInChI=1S/3CH5AsO3.6Na/c3*1-2(3,4)5;;;;;;/h3*1H3,(H2,3,4,5);;;;;;/q;;;6*+1/p-6
InChIKeyULYZWKASEBATHJ-UHFFFAOYSA-H
MW551.80 g/mol
LogP-24.86
Rot. Bonds

About hexasodium;tris(methyl-dioxido-oxo-λ5-arsane)

hexasodium;tris(methyl-dioxido-oxo-λ5-arsane) (PubChem CID 173326261) has the molecular formula C3H9As3Na6O9 and a molecular weight of 551.80 g/mol. Its IUPAC name is hexasodium;tris(methyl-dioxido-oxo-λ5-arsane).

Molecular Properties

Compound Namehexasodium;tris(methyl-dioxido-oxo-λ5-arsane)
PubChem CID173326261
Molecular FormulaC3H9As3Na6O9
Molecular Weight551.80 g/mol
Exact Mass551.73
IUPAC Namehexasodium;tris(methyl-dioxido-oxo-λ5-arsane)
SMILESC[As](=O)([O-])[O-].C[As](=O)([O-])[O-].C[As](=O)([O-])[O-].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]
InChIInChI=1S/3CH5AsO3.6Na/c3*1-2(3,4)5;;;;;;/h3*1H3,(H2,3,4,5);;;;;;/q;;;6*+1/p-6
InChIKeyULYZWKASEBATHJ-UHFFFAOYSA-H
XLogP-24.86
TPSA189.57 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500551.80
LogP ≤ 5-24.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

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

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Related Compounds

tris(dimethylarsinate);iron(3+)
CID 22273
sodium;dimethylarsorylmethane;hydride
CID 175026374
tris(nickel(2+)) diarsorate
CID 19786074
diazanium;arsorate
CID 23618854
tris(zirconium(4+));tetraarsorate
CID 173165970
nickel(3+) arsorate
CID 57348043
tricopper diarsorate
CID 26065
pentacopper;sodium;hydrogen arsorate;triarsorate
CID 165361798
hydrogen arsorate
CID 233
dimethylarsinic acid
CID 87073608
azanium;molybdenum(2+);arsorate
CID 174277284
tris(zirconium(4+));tetraarsorate;hydrate
CID 173447280

Frequently Asked Questions

What is the IUPAC name of hexasodium;tris(methyl-dioxido-oxo-λ5-arsane)?
The IUPAC name of hexasodium;tris(methyl-dioxido-oxo-λ5-arsane) (CID 173326261) is hexasodium;tris(methyl-dioxido-oxo-λ5-arsane).
What is the SMILES notation for hexasodium;tris(methyl-dioxido-oxo-λ5-arsane)?
The canonical SMILES for hexasodium;tris(methyl-dioxido-oxo-λ5-arsane) is C[As](=O)([O-])[O-].C[As](=O)([O-])[O-].C[As](=O)([O-])[O-].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].
What is the InChIKey of hexasodium;tris(methyl-dioxido-oxo-λ5-arsane)?
The InChIKey is ULYZWKASEBATHJ-UHFFFAOYSA-H. The full InChI is InChI=1S/3CH5AsO3.6Na/c3*1-2(3,4)5;;;;;;/h3*1H3,(H2,3,4,5);;;;;;/q;;;6*+1/p-6.
What are the key properties of hexasodium;tris(methyl-dioxido-oxo-λ5-arsane)?
hexasodium;tris(methyl-dioxido-oxo-λ5-arsane) has a molecular weight of 551.80 g/mol, XLogP of -24.86, 0 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for hexasodium;tris(methyl-dioxido-oxo-λ5-arsane) is sourced from PubChem (CID 173326261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).