phenylmercurio acetate

• ChemBase ID: 128934
• Molecular Formular: C8H8HgO2
• Molecular Mass: 336.73792
• Monoisotopic Mass: 338.0230725
• SMILES: CC(=O)O[Hg]c1ccccc1
• Canonical SMILES: CC(=O)O[Hg]c1ccccc1
• InChI: InChI=1S/C6H5.C2H4O2.Hg/c1-2-4-6-5-3-1;1-2(3)4;/h1-5H;1H3,(H,3,4);/q;;+1/p-1
• InChIKey: XEBWQGVWTUSTLN-UHFFFAOYSA-M

NAMES AND DATABASE IDS

Names

• IUPAC name: phenylmercurio acetate
• IUPAC Systematic name: Phenylmercurio acetate
• IUPAC Traditional name: anticon
• Synonyms: Phenylmercury acetate; Mercury phenyl acetate; Phenylmercury acetate; Phenylmercuric acetate; Phenylmercury acetate; Phenylmercuric Acetate; 乙酸苯汞; 醋酸苯汞; 醋酸苯汞

Database IDs

• CAS Number: 62-38-4
• EC Number: 200-532-5
• MDL Number: MFCD00008691
• Beilstein Number: 3662930
• PubChem SID: 24887408; 162223236; 24898353
• PubChem CID: 16682730
• CHEBI ID: 27684
• Chemspider ID: 10294750
• Gmelin ID: 83357
• KEGG ID: D05464
• MeSH Name: Phenylmercuric+acetate
• Unique Ingredient Identifier: OSX88361UX
• Wikipedia Title: Phenylmercury_acetate

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 0
• LogD (pH = 5.5): 0.8455
• LogD (pH = 7.4): 0.8455
• Log P: 0.8455
• Molar Refractivity: 37.1904 cm^3
• Polarizability: 22.07244 Å^3
• Polar Surface Area: 26.3 Å^2
• Rotatable Bonds: 3
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Melting Point: 148 - 151°C; 148-151 °C; 148-151 °C(lit.)

Safety Information

• RTECS: OV6475000
• European Hazard Symbols: Nature polluting (N); Toxic (T)
• UN Number: 1674
• German water hazard class: 3
• Hazard Class: 6.1
• Packing Group: 2
• Risk Statements: 25-34-48/24/25-50/53; R25, R34, R48/24/25, R50/53
• Safety Statements: 23-24/25-37-45-60-61; S1/2, S23, S24/25, S37, S45, S60, S61
• EU Index: 080-011-00-5
• GHS Pictograms: GHS05; GHS06; GHS08; GHS09
• GHS Signal Word: Danger
• GHS Hazard statements: H301-H314-H372-H410
• GHS Precautionary statements: P273-P280-P301 + P310-P305 + P351 + P338-P310-P501
• Personal Protective Equipment: Eyeshields, Faceshields, full-face particle respirator type N100 (US), Gloves, respirator cartridge type N100 (US), type P1 (EN143) respirator filter, type P3 (EN 143) respirator cartridges
• RID/ADR: UN 1674 6.1/PG 2

Product Information

• Purity: ≥98.0% (Hg); 97%
• Grade: NF 19; purum
• Pharmacopeia: testing & handling conforms to Pharmacopeia
• Linear Formula: C6H5HgOCOCH3

DETAILS

Sigma Aldrich - P27127

Packaging
25 g in glass bottle