phenylmercurol phenylmercurio nitrate

• ChemBase ID: 137283
• Molecular Formular: C12H11Hg2NO4
• Molecular Mass: 634.40004
• Monoisotopic Mass: 637.01009384
• SMILES: c1ccc(cc1)[Hg]O.c1ccc(cc1)[Hg]O[N+](=O)[O-]
• Canonical SMILES: [O-][N+](=O)O[Hg]c1ccccc1.O[Hg]c1ccccc1
• InChI: InChI=1S/2C6H5.2Hg.NO3.H2O/c2*1-2-4-6-5-3-1;;;2-1(3)4;/h2*1-5H;;;;1H2/q;;2*+1;-1;/p-1
• InChIKey: DQZCXZOUXZTNCU-UHFFFAOYSA-M

NAMES AND DATABASE IDS

Names

• IUPAC name: phenylmercurol phenylmercurio nitrate
• IUPAC Traditional name: phenylmercurol phenylmercuric nitrate
• Synonyms: Phenylmercury nitrate; Phenylmercuric nitrate, basic; Phenylmercury nitrate; Phenylmercuric nitrate, basic; 硝酸苯汞; 硝酸苯汞; 碱性硝酸苯汞; 碱性硝酸苯汞

Database IDs

• CAS Number: 8003-05-2
• MDL Number: MFCD00151098
• PubChem SID: 162231547; 24853536; 24887410; 24899134
• PubChem CID: 16683092

CALCULATED PROPERTIES

• H Acceptors: 3
• H Donor: 0
• LogD (pH = 5.5): 1.5714
• LogD (pH = 7.4): 1.5714
• Log P: 1.5714
• Molar Refractivity: 34.7329 cm^3
• Polarizability: 20.543453 Å^3
• Polar Surface Area: 55.05 Å^2
• Rotatable Bonds: 4
• Lipinski's Rule of Five: false

PROPERTIES

Physical Property

• Melting Point: 175-185 °C (dec.)(lit.)

Safety Information

• RTECS: OW8400000; OW8575000
• European Hazard Symbols: Nature polluting (N); Toxic (T)
• UN Number: 1895
• German water hazard class: 3
• Hazard Class: 6.1
• Packing Group: 2
• Risk Statements: 25-34-48/24/25-50/53
• Safety Statements: 23-24/25-37-45-60-61
• 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 1895 6.1/PG 2

Product Information

• Purity: ≥97.0% (RT)
• Grade: analytical standard
• Packaging: ampule of 100 mg
• Linear Formula: C6H5HgNO3·C6H5HgOH

DETAILS

Sigma Aldrich - 79135

Packaging
50 g in poly bottle