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51580-86-0

51580-86-0 structural image
Product Name: 1,3-Dichloro-1,3,5-triazine-2,4,6(1H,3H,5H)-trione sodium salt dihydrate
Formula: C3H4Cl2N3NaO4
Synonyms: 1,3-Dichloro-1,3,5-triazine-2,4,6-trione sodium salt;Dichloroisocyanuric acid sodium salt dihydrate;NaDCC
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Dry Powder; Liquid
Color/Form White, free-flowing crystalline powder or granular solid
Odor Chlorine odor
Solubility Solubility in water, g/100ml at 25 °C: 25 (freely soluble)
Density Density (at 20 °C): 0.96 g/cm³
Decomposition > 240 °C
Accelerating Rate Calorimetry (ARC) 49.3°C (Time to Maximum Rate at 24 hours temperature); 81.9°C (Temperature of first exotherm); 0.2 hours (Time to Maximum Rate at first exotherm); 17,571 psi/minute at 128.18°C (Pressure rate of test)
Differential Scanning Calorimetry (DSC) 114.1°C (Exotherm start temperature); 1077 J/g (Exotherm energy)
Self-Accelerating Decomposition Temperature (SADT) 45°C to 65°C (estimated using 135KG sample)
Chemical Classes Other Uses -> Biocides/Disinfectants

SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07

Environment
GHS09
GHS Hazard Statements H302:Acute toxicity,oral
H319:Serious eye damage/eye irritation
H335:Specific target organ toxicity, single exposure;Respiratory tract irritation
H410:Hazardous to the aquatic environment, long-term hazard
Precautionary Statement Codes P261:Avoid breathing dust/fume/gas/mist/vapours/spray.
P264:Wash hands thoroughly after handling.
P264:Wash skin thouroughly after handling.
P270:Do not eat, drink or smoke when using this product.
P273:Avoid release to the environment.
P301+P312:IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell.
P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

COMPUTED DESCRIPTORS

Molecular Weight 255.97 g/mol
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 0
Exact Mass 254.9425699 g/mol
Monoisotopic Mass 254.9425699 g/mol
Topological Polar Surface Area 78 Ų
Heavy Atom Count 14
Formal Charge 0
Complexity 257
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 4
Compound Is Canonicalized Yes