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21259-75-6

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Basic Information
CAS No.: 21259-75-6
Name: BIS(TRIFLUOROMETHYLTHIO)MERCURY
Article Data: 18
Molecular Structure:
Molecular Structure of 21259-75-6 (BIS(TRIFLUOROMETHYLTHIO)MERCURY)
Formula: C2F6HgS2
Molecular Weight: 402.734
Synonyms: mercury trifluoromethylmercaptide;Bis(trifluoromethylthio)quecksilber;Bis(trifluormethylsulfanyl)quecksilber;bis(trifluoromethylthio)-mercur;Bis<(trifluoromethyl)thio>mercury;mercury bis(trifluoromethanethiolate);
Density: g/cm3
Melting Point: 39oC
Boiling Point: °Cat760mmHg
Flash Point: °C
Hazard Symbols: A poison. TWA 0.01. STEL 0.03 mg/m3 (skin)
Risk Codes: R26/27/28
Safety: A poison by intravenous route. When heated to decomposition it emits toxic vapors of SOx and Hg.
PSA: 50.60000
LogP: 3.40490
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Chemistry

IUPAC Name: Mercury(2+); trifluoromethanethiolate
Synonyms of Bis(trifluoromethylthio)mercury (CAS NO.21259-75-6): Mercury, bis(trifluoromethylthio)-
InChI: InChI=1/2CHF3S.Hg/c2*2-1(3,4)5;/h2*5H;/q;;+2/p-2
InChIKey: QHACEJBZGFEEJE-NUQVWONBAR
Std. InChI: InChI=1S/2CHF3S.Hg/c2*2-1(3,4)5;/h2*5H;/q;;+2/p-2
Std. InChIKey: QHACEJBZGFEEJE-UHFFFAOYSA-L
CAS NO: 21259-75-6
Molecular Formula: C2F6HgS2
Molecular Weight: 402.7318
Molecular Structure :
H bond acceptors: 0
H bond donors: 0
Freely Rotating Bonds: 0
Polar Surface Area: 38.8 Å2
Enthalpy of Vaporization: 20.92 kJ/mol
Vapour Pressure: 6010 mmHg at 25°C
Melting Point: 39°C
Melting Point: 182°C
Density: 2,911 g/cm3

Toxicity Data With Reference

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 7500ug/kg (7.5mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#08848,

Safety Profile

Hazard Codes: ToxicT
Risk Statements: 26/27/28
R26/27/28: Bis(trifluoromethylthio)mercury (CAS NO.21259-75-6) is very toxic by inhalation, in contact with skin and if swallowed.
Safety Statements: 36/37/39-45
S36/37/39: Wear suitable protective clothing, gloves and eye/face protection.  
S45: In case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.) 
RIDADR: 2025
Hazard Note Highly Toxic/Inhalation Hazard
A poison by intravenous route. When Bis(trifluoromethylthio)mercury (CAS NO.21259-75-6) is heated to decomposition ,it emits toxic vapors of SOx and Hg.

Standards and Recommendations

ACGIH TLV: TWA 0.01. STEL 0.03 mg/m3 (skin)
NIOSH REL: (MERCURY, ORGANO) TWA 0.01 mg/m3. STEL 0.03 mg/m3 (Sk)