chloro(phenyl)mercury

• ChemBase ID: 138991
• Molecular Formular: C6H5ClHg
• Molecular Mass: 313.1469
• Monoisotopic Mass: 313.97862084
• SMILES: c1ccc(cc1)[Hg]Cl
• Canonical SMILES: Cl[Hg]c1ccccc1
• InChI: InChI=1S/C6H5.ClH.Hg/c1-2-4-6-5-3-1;;/h1-5H;1H;/q;;+1/p-1
• InChIKey: AWGTVRDHKJQFAX-UHFFFAOYSA-M

NAMES AND DATABASE IDS

Names

• IUPAC name: chloro(phenyl)mercury
• IUPAC Traditional name: phenyl mercuric chloride
• Synonyms: Phenylmercury chloride; Phenylmercuric chloride; Phenylmercury chloride; Phenyl mercuric chloride; 苯基氯化汞; 苯基氯化汞

Database IDs

• CAS Number: 100-56-1
• EC Number: 202-865-1
• MDL Number: MFCD00000463
• Beilstein Number: 3536717
• PubChem SID: 162233242; 24887409; 24899167; 24869135; 24898355
• PubChem CID: 7511

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 1.5367
• LogD (pH = 7.4): 1.5367
• Log P: 1.5367
• Molar Refractivity: 31.6106 cm^3
• Polarizability: 19.469349 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Melting Point: 248-250 °C (dec.)(lit.)

Safety Information

• RTECS: OW1400000
• European Hazard Symbols: Nature polluting (N); Highly toxic (T+)
• UN Number: 2026
• German water hazard class: 3
• Hazard Class: 6.1
• Packing Group: 3
• Risk Statements: 26/27/28-33-50/53
• Safety Statements: 13-28-36-45-60-61
• GHS Pictograms: GHS06; GHS08; GHS09
• GHS Signal Word: Danger
• GHS Hazard statements: H300-H310-H330-H373-H410
• GHS Precautionary statements: P260-P264-P273-P280-P284-P301 + P310
• Personal Protective Equipment: dust mask type N95 (US), Eyeshields, Faceshields, Gloves, type P2 (EN 143) respirator cartridges; 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 2026 6.1/PG 3

Product Information

• Purity: ≥95.0% (Hg)
• Grade: analytical standard; PESTANAL®, analytical standard; purum
• Packaging: ampule of 1000 mg
• Linear Formula: C6H5HgCl

DETAILS

Sigma Aldrich - P27135

Packaging
25 g in glass bottle

Sigma Aldrich - 45619

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