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587-85-9

Basic Information
CAS No.: 587-85-9
Name: Diphenylmercury
Article Data: 95
Molecular Structure:
Molecular Structure of 587-85-9 (Diphenylmercury)
Formula: C12H10 Hg
Molecular Weight: 354.801
Synonyms: Benzene,mercuriodi-; Diphenylmercury; NSC 23990
EINECS: 209-606-1
Density: g/cm3
Melting Point: 124 °C
Boiling Point: >306°C
Flash Point: °C
Solubility: Insoluble in water.
Appearance: White to beige powder
Hazard Symbols: R26/27/28:Very toxic by inhalation, in contact with skin and if swallowed.; R33:Danger of cumulative effects.; R50
Risk Codes:  T+:Very toxic;
">  T+:Very toxic;
Safety: Poison by intraperitoneal route. Moderately toxic by ingestion. Incompatible with nonmetal oxides. When heated to decomposition it emits toxic fumes of Hg. See also MERCURY COMPOUNDS, INORGANIC; MERCURY COMPOUNDS, ORGANIC.
PSA: 0.00000
LogP: 1.71990
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Chemistry

Molecule structure of Diphenylmercury (CAS NO.587-85-9) :

IUPAC Name: diphenylmercury 
Molecular Weight: 354.7978 g/mol
Molecular Formula: C12H10Hg 
Density: 2.32 g/mL at 25 °C(lit.)
Melting Point: 124 °C
Boiling Point: >306°C
Flash Point: >306°C
Storage Temp.: poison room 
Rotatable Bond Count: 2
Exact Mass: 356.048876
MonoIsotopic Mass: 356.048876
Heavy Atom Count: 13
Complexity: 116
Canonical SMILES: C1=CC=C(C=C1)[Hg]C2=CC=CC=C2
InChI: InChI=1S/2C6H5.Hg/c2*1-2-4-6-5-3-1;/h2*1-5H;
InChIKey: HWMTUNCVVYPZHZ-UHFFFAOYSA-N
EINECS: 209-606-1

Production

 Diphenylmercury (CAS NO.587-85-9) can be synthesised by the reaction of a 2:1 molar ratio of mercury(II) chloride and methyltriphenyltin in ethanol.

Toxicity Data With Reference

1.    

orl-rat LDLo:500 mg/kg

    NCNSA6    National Academy of Sciences, National Research Council, Chemical-Biological Coordination Center, Review. 5 (1953),30.
2.    

ipr-rat LDLo:50 mg/kg

    NCNSA6    National Academy of Sciences, National Research Council, Chemical-Biological Coordination Center, Review. 5 (1953),30.
3.    

ipr-mus LDLo:250 mg/kg

    CBCCT*    “Summary Tables of Biological Tests” National Research Council Chemical-Biological Coordination Center. 4 (1952),231.

Consensus Reports

Reported in EPA TSCA Inventory. Mercury and its compounds are on the Community Right-To-Know List.

Safety Profile

Poison by intraperitoneal route. Moderately toxic by ingestion. Incompatible with nonmetal oxides. When heated to decomposition it emits toxic fumes of Hg. See also MERCURY COMPOUNDS, INORGANIC; MERCURY COMPOUNDS, ORGANIC.
Hazard Codes: VeryT+, DangerousN
Risk Statements: 26/27/28-33-50/53 
R26/27/28: Very toxic by inhalation, in contact with skin and if swallowed. 
R33: Danger of cumulative effects. 
R50/53: Very toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment.
Safety Statements: 13-28-36-45-60-61
S13: Keep away from food, drink and animal foodstuffs. 
S28: After contact with skin, wash immediately with plenty of soap-suds. 
S36: Wear suitable protective clothing. 
S45: In case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.) 
S60: This material and its container must be disposed of as hazardous waste. 
S61: Avoid release to the environment. Refer to special instructions / safety data sheets.
RIDADR: UN 2026 6.1/PG 3
WGK Germany: 3
RTECS: OW3150000
HazardClass: 6.1
PackingGroup: II

Standards and Recommendations

OSHA PEL: CL 0.1 mg(Hg)/m3 (skin)
ACGIH TLV: TWA 0.1 mg(Hg)/m3 (skin); BEI: 35 µg/g creatinine total inorganic mercury in urine preshift; 15 µg/g creatinine total inorganic mercury in blood at end of shift at end of workweek.
DFG MAK: Confirmed Animal Carcinogen with Unknown Relevance to Humans
NIOSH REL: (Mercury, Aryl and Inorganic) CL 0.1 mg/m3 (skin)

Specification

 Diphenylmercury (CAS NO.587-85-9) is also called 4-16-00-01702 (Beilstein Handbook Reference); AI3-17856 ; BRN 0637234 ; Benzene, mercuriodi- ; Difenylrtut [Czech] ; NSC 23990 ;Mercury, diphenyl- . Diphenylmercury (CAS NO.587-85-9) is a colourless, crystalline organomercury compound. Diphenylmercury (CAS NO.587-85-9) is a kind of pesticides. It is high toxic. It is flammable by fire. It will decomposit toxic mercury-containing compounds fumes by high heat. So the storage environment should be ventilate, low-temperature and dry. Keep Diphenylmercury (CAS NO.587-85-9) separate from oxidants, food additives and acids.