mercury(2+) ion tetrakis(cyanosulfanyl)cobaltdiuide

• ChemBase ID: 137965
• Molecular Formular: C4CoHgN4S4
• Molecular Mass: 491.8528
• Monoisotopic Mass: 492.80441802
• SMILES: C(#N)S[Co-2](SC#N)(SC#N)SC#N.[Hg+2]
• Canonical SMILES: N#CS[Co-2](SC#N)(SC#N)SC#N.[Hg+2]
• InChI: InChI=1S/4CHNS.Co.Hg/c4*2-1-3;;/h4*3H;;/q;;;;2*+2/p-4
• InChIKey: CKGHPFRRZBSWMC-UHFFFAOYSA-J

NAMES AND DATABASE IDS

Names

• IUPAC name: mercury(2+) ion tetrakis(cyanosulfanyl)cobaltdiuide
• IUPAC Traditional name: mercury(2+) ion tetrakis(cyanosulfanyl)cobaltdiuide
• Synonyms: Mercury thiocyanatocobaltate(II); Cobalt(II) tetrathiocyanatomercurate(II); Mercury(II) tetrathiocyanatocobaltate(II); 四硫代氰钴(II)酸汞; 四硫代氰钴酸汞

Database IDs

• CAS Number: 27685-51-4
• EC Number: 248-602-4
• MDL Number: MFCD00011048
• PubChem SID: 24854004; 162232224
• PubChem CID: 2735076

CALCULATED PROPERTIES

• H Acceptors: 4
• H Donor: 0
• LogD (pH = 5.5): 1.6184
• LogD (pH = 7.4): 1.6184
• Log P: 1.6184
• Molar Refractivity: 57.7964 cm^3
• Polarizability: 23.821846 Å^3
• Polar Surface Area: 95.16 Å^2
• Rotatable Bonds: 4
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Apperance: powder and chunks

Safety Information

• European Hazard Symbols: Toxic (T)
• UN Number: 2025
• German water hazard class: 3
• Hazard Class: 6.1
• Packing Group: 2
• Risk Statements: 23/24/25-36/37/38
• Safety Statements: 22-26-36/37/39-45
• GHS Pictograms: GHS06
• GHS Signal Word: Danger
• GHS Hazard statements: H301-H311-H315-H319-H331-H335
• GHS Precautionary statements: P261-P280-P301 + P310-P305 + P351 + P338-P311
• Personal Protective Equipment: Eyeshields, Faceshields, Gloves, type P2 (EN 143) respirator cartridges
• RID/ADR: UN 2025 6.1/PG 2

Product Information

• Linear Formula: HgCo(SCN)4

DETAILS

Sigma Aldrich - 233684

Application
High-purity magnetic-susceptibility standard
Packaging
5, 25 g in poly bottle