5,8,11-trioxa-2-thia-1-auradodecane

• ChemBase ID: 141223
• Molecular Formular: C7H15AuO3S
• Molecular Mass: 376.22375
• Monoisotopic Mass: 376.04075834
• SMILES: COCCOCCOCCS[Au]
• Canonical SMILES: COCCOCCOCCS[Au]
• InChI: InChI=1S/C7H16O3S.Au/c1-8-2-3-9-4-5-10-6-7-11;/h11H,2-7H2,1H3;/q;+1/p-1
• InChIKey: HHDHDTISDDNGEI-UHFFFAOYSA-M

NAMES AND DATABASE IDS

Names

• IUPAC name: 5,8,11-trioxa-2-thia-1-auradodecane
• IUPAC Traditional name: 5,8,11-trioxa-2-thia-1-auradodecane
• Synonyms: 1-Mercapto-(triethylene glycol) methyl ether functionalized gold nanoparticles; 1-巯基-(三乙二醇)甲基醚官能化金纳米粒子 溶液

Database IDs

• PubChem SID: 162235458
• PubChem CID: 71310584

CALCULATED PROPERTIES

• H Acceptors: 3
• H Donor: 0
• LogD (pH = 5.5): -0.1886
• LogD (pH = 7.4): -0.1886
• Log P: -0.1886
• Molar Refractivity: 46.7867 cm^3
• Polarizability: 25.7221 Å^3
• Polar Surface Area: 27.69 Å^2
• Rotatable Bonds: 9
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Solubility: acetone: soluble; acetonitrile: slightly soluble; alcohol: soluble; chloroform: soluble; ethyl acetate: soluble; H2O: soluble; toluene: soluble
• Apperance: solution
• Flash Point: 12 °C; 53.6 °F
• Density: 0.793 g/mL at 25 °C

Safety Information

• European Hazard Symbols: Flammable (F)
• UN Number: 1170
• German water hazard class: 2
• Hazard Class: 3
• Packing Group: 2
• Risk Statements: 11
• Safety Statements: 16
• GHS Pictograms: GHS02
• GHS Signal Word: Danger
• GHS Hazard statements: H225
• GHS Precautionary statements: P210
• Personal Protective Equipment: Eyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
• RID/ADR: UN 1170 3/PG 2
• Storage Temperature: -20°C

Product Information

• Concentration: 2 % (w/v) in absolute ethanol
• Particle Size: 3.5-5.5 nm (TEM)

DETAILS

Sigma Aldrich - 694169

General description
Monodispersed gold nanoparticles soluble in both polar (water) and organic (toluene) solvents.
Packaging
5 mL in glass bottle