diphenylmercury

• ChemBase ID: 138274
• Molecular Formular: C12H10Hg
• Molecular Mass: 354.7978
• Monoisotopic Mass: 356.04889332
• SMILES: c1ccc(cc1)[Hg]c1ccccc1
• Canonical SMILES: c1ccc(cc1)[Hg]c1ccccc1
• InChI: InChI=1S/2C6H5.Hg/c2*1-2-4-6-5-3-1;/h2*1-5H
• InChIKey: HWMTUNCVVYPZHZ-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: diphenylmercury
• IUPAC Traditional name: diphenylmercury
• Synonyms: Diphenylmercury; Mercury(II)diphenyl; Diphenylmercury(II); 二苯汞(II); 二苯基汞

Database IDs

• CAS Number: 587-85-9
• EC Number: 209-606-1
• MDL Number: MFCD00002998
• Beilstein Number: 637234
• PubChem SID: 162232531; 24853735; 24868936
• PubChem CID: 11488

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 3.4044
• LogD (pH = 7.4): 3.4044
• Log P: 3.4044
• Molar Refractivity: 50.9486 cm^3
• Polarizability: 26.78181 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Apperance: Powder
• Melting Point: 121-124 °C(lit.); 124-125°C
• Boiling Point: >306°C dec.
• Density: 2.318; 2.32 g/mL at 25 °C(lit.)

Safety Information

• RTECS: OW3150000
• European Hazard Symbols: Nature polluting (N); Highly toxic (T+)
• UN Number: 2026; UN2026
• German water hazard class: 3
• Hazard Class: 6.1
• Packing Group: 3; II
• Risk Statements: 26/27/28-33-50/53
• Safety Statements: 13-28-36-45-60-61
• TSCA Listed: 是
• GHS Pictograms: GHS06; GHS08; GHS09
• GHS Signal Word: Danger
• GHS Hazard statements: H300 +H310 + H330-H373-H410; H300-H310-H330-H373-H400-H410; H300-H310-H330-H373-H410
• GHS Precautionary statements: P260-P264-P273-P280-P284-P301 + P310; P260-P301+P310-P304+P340-P320-P330-P361-P405-P501A
• Personal Protective Equipment: dust mask type N95 (US), Eyeshields, Faceshields, Gloves, type P2 (EN 143) respirator cartridges
• RID/ADR: UN 2026 6.1/PG 3

Product Information

• Grade: PESTANAL®, analytical standard
• Linear Formula: (C6H5)2Hg

DETAILS

Sigma Aldrich - 229199

Packaging
10, 50 g in glass bottle

Sigma Aldrich - 45457

Legal Information
PESTANAL is a registered trademark of Sigma-Aldrich Laborchemikalien GmbH