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54-64-8

54-64-8 structural image
Product Name: Thimerosal
Formula: C9H9HgNaO2S
Synonyms: Thimerosal;([o-Carboxyphenyl]thio)ethylmercury sodium salt;2-(Ethylmercuriomercapto)benzoic acid sodium salt;Ethylmercurithiosalicylic acid sodium salt;Mercury-([o-carboxyphenyl]thio)ethyl sodium salt
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Mercury((o-carboxyphenyl)thio)ethyl, sodium salt is a light cream-colored crystalline powder with a slight odor: pH (1% aqueous solution) 6.7. Slight odor. (NTP, 1992)
Color/Form Cream colored, crystalline powder
Odor Characteristic odor
Boiling Point 357.3
Melting Point 450 to 451 °F (decomposes) (NTP, 1992)
Solubility greater than or equal to 100 mg/mL at 66 °F (NTP, 1992)
LogP log Kow = -1.88 /Estimated/
Stability/Shelf Life Stable in air, but not in sunlight.
Decomposition When heated to decomposition it emits very toxic fumes of /mercury, sodium oxides, and sulfur oxides/.
pH pH (1% solution): 6.7
Other Experimental Properties Stable in air but not sunlight
Chemical Classes Other Uses -> Preservatives

SAFETY INFORMATION

Signal word Danger
Pictogram(s)

Skull and Crossbones
Acute Toxicity
GHS06

Health Hazard
GHS08

Environment
GHS09
GHS Hazard Statements H373:Specific target organ toxicity, repeated exposure
H410:Hazardous to the aquatic environment, long-term hazard
Precautionary Statement Codes P262:Do not get in eyes, on skin, or on clothing.
P273:Avoid release to the environment.
P280:Wear protective gloves/protective clothing/eye protection/face protection.
P314:Get medical advice/attention if you feel unwell.

COMPUTED DESCRIPTORS

Molecular Weight 404.82 g/mol
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 3
Exact Mass 405.992739 g/mol
Monoisotopic Mass 405.992739 g/mol
Topological Polar Surface Area 65.4 Ų
Heavy Atom Count 14
Formal Charge 0
Complexity 180
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 2
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Mercury((o-carboxyphenyl)thio)ethyl, sodium salt is a light cream-colored crystalline powder with a slight odor: pH (1% aqueous solution) 6.7. Slight odor. (NTP, 1992)

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