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2,4,5-Trichlorophenol

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CAS:95-95-4
Purity:98%(Min,GC) Package:100g;1kg;5kg,10kg,25kg,50kg
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CAS:95-95-4
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2,4,5-Trichlorophenol Basic information
Product Name:2,4,5-Trichlorophenol
Synonyms:2,4,5-trichloro-pheno;2,4,5-trichlorophenolsaltof2,6-bis((dimethylamino)methyl)cyclohexanone;caswellno.879;Dowcide 2;epapesticidechemicalcode064210;NCI-C61187;Nurelle;Preventol I
CAS:95-95-4
MF:C6H3Cl3O
MW:197.45
EINECS:202-467-8
Product Categories:Building Blocks;C6 to C8;Condensation & Active Esterification;Synthetic Organic Chemistry;Alphabetic;Pesticides&Metabolites;Q-ZAlphabetic;Organic Building Blocks;Oxygen Compounds;Phenols;Alpha Sort;Analytical Standards;AromaticsChemical Class;Chemical Class;ChloroAnalytical Standards;Halogenated;PhenolsVolatiles/ Semivolatiles;TP - TZ;T-ZAlphabetic;Chemical Synthesis;Organic Building Blocks;Oxygen Compounds
Mol File:95-95-4.mol
2,4,5-Trichlorophenol Structure
2,4,5-Trichlorophenol Chemical Properties
Melting point 64-67 °C 67-69 °C (lit.)
Boiling point 248 °C/740 mmHg (lit.)
density 1,678 g/cm3
vapor pressure 3.5 at 8 °C, 22 at 25 °C (quoted, Leuenberger et al., 1985a)
refractive index 1.5300 (estimate)
Fp 253°C
storage temp. 2-8°C
solubility Soluble in ethanol and ligroin (U.S. EPA, 1985)
pkapK1:7.37 (25°C)
form Powder
color Colorless needles or gray flakes from pet ether
Odorstrong phenolic odor
Water Solubility 947.8mg/L(25 ºC)
Merck 14,9643
BRN 607569
Henry's Law Constant1.76 at 25 °C (estimated, Leuenberger et al., 1985a)
Stability:Stable. Note that this material creates dioxin in alkaline media at elevated temperatures.
CAS DataBase Reference95-95-4(CAS DataBase Reference)
NIST Chemistry ReferencePhenol, 2,4,5-trichloro-(95-95-4)
EPA Substance Registry System2,4,5-Trichlorophenol (95-95-4)
Safety Information
Hazard Codes Xn,N,Xi,T,F
Risk Statements 22-36/38-50/53-52/53-39/23/24/25-23/24/25-11-51/53
Safety Statements 26-28-60-61-28A-45-36/37-16
RIDADR UN 3077 9/PG 3
WGK Germany 3
RTECS SN1400000
TSCA Yes
HazardClass 6.1
PackingGroup III
HS Code 29081990
Hazardous Substances Data95-95-4(Hazardous Substances Data)
ToxicityAcute oral LD50 for guinea pigs 1,000 mg/kg, mice 600 mg/kg, rats 820 mg/kg (quoted, RTECS, 1985).
MSDS Information
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2,4,5-Trichlorophenol English
SigmaAldrich English
ACROS English
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2,4,5-Trichlorophenol Usage And Synthesis
Chemical PropertiesWhite to pale brown solid in appearance; 2,4,5-Trichlorophenol also looks like small needles. It has a really strong odor that smells like phenol (a poisonous crystal-looking compound). This man-made substance is not found naturally in the environment.
Physical propertiesColorless crystals or yellow to gray flakes with a strong, disinfectant or phenolic odor. At 40 °C, the average odor threshold concentration and the lowest concentration at which an odor were detected were 350 and 63 μg/L, respectively. At 25 °C, the lowest concentration at which a taste was detected was 100 μg/L (Young et al., 1996).
Uses2,4,5-Trichlorophenol is used as a broad range pesticide against insects, fungi, vegetation and bacteria. It has become a common environmental contaminant and probable human carcinogen.
Preparation2,4,5-Trichlorophenol is prepared indirectly, by the alkaline hydrolysis of 1,2,4,5-tetrachlorobenzene,because the direct chlorination of 2,5-dichlorophenol, difficult to achieve, proceeds with poor yield.
DefinitionChEBI: 2,4,5-trichlorophenol is a trichlorophenol carrying chloro groups at positions 2, 4 and 5.
General DescriptionColorless needles, gray flakes or off-white lumpy solid. Phenolic odor. Formerly used as a fungicide and bactericide.
Air & Water ReactionsInsoluble in water.
Reactivity Profile2,4,5-Trichlorophenol is a weak monobasic acid. Incompatible with acid chlorides, acid anhydrides and oxidizing agents. Produces dioxin in alkaline medium at high temperatures
Health HazardIf your skin comes into contact with 2,4,5-trichlorophenol, it may burn the skin and produce redness and edema in humans. It also irritates the eyes, nose, pharynx, and lungs in humans.
Tests involving acute exposure of rats, mice, and guinea pigs have demonstrated 2,4,5-trichlorophenol to havemoderateacute toxicity by oral exposure.
Fire HazardLiterature sources indicate that 2,4,5-Trichlorophenol is nonflammable.
Safety ProfileSuspected carcinogen with experimental neoplastigenic data. Poison by intraperitoneal and intravenous routes. Moderately toxic by ingestion and subcutaneous routes. Experimental reproductive effects. Mutation data reported. When heated to decomposition it emits toxic fumes of Cland explodes. See also CHLOROPHENOLS.
Environmental fateBiological. Chloroperoxidase, a fungal enzyme isolated from Caldariomyces fumago, chlorinated 2,4,5-trichlorophenol to give 2,3,4,6-tetrachlorophenol (Wannstedt et al., 1990).
Photolytic. When 2,4,5-trichlorophenol (100 μM) in an oxygenated, titanium dioxide (2 g/L) suspension was irradiated by sunlight (λ ≥340 nm), complete mineralization to carbon dioxide and water and chloride ions was observed (Barbeni et al., 1987a).
The following phototransformation half-lives were reported for 2,4,5-trichlorophenol in estuarine water exposed to sunlight and microbes: 1 h during winter; in distilled water: 0.6 and 1 h during summer and winter, respectively; in poisoned estuarine water: 14 and 24 h during summer and winter, respectively (Hwang et al., 1986).
A photooxidation rate constant of <3,000/M·sec was reported for the reaction of 2,4,5- trichlorophenol and ozone in water at a pH range of 1.2 to 1.5 (Hoigné and Bader, 1983). Chemical/Physical. 2,4,5-Trichlorophenol will not hydrolyze because it does not contain a hydrolyzable functional group (Kollig, 1993).
During the manufacture/synthesis of 2,4,5-T using alkalies at high temperatures, some TCDD may form (Worthing and Hance, 1991).
Purification MethodsCrystallise the phenol from EtOH or pet ether. [Beilstein 6 IV 962.]
Tag:2,4,5-Trichlorophenol(95-95-4) Related Product Information
Trichloroacetic acid PHENOLDISULFONIC ACID Sucralose Trichloroethylene Trichlorosilane 2,4-Dichlorophenol 1,3,5-Trichlorobenzene Trichloroisocyanuric acid Chloroform Pentachlorophenol 2,3,4,6-TETRACHLOROPHENOL 2,4,6-trichlorophenol solution,1,3,5-Trichlorophenol 2-(2,4,5-TRICHLOROPHENOXY)PROPIONIC ACID Pentachlorophenol sodium salt hydrate 2,3,4,5-TETRACHLOROANISOLE Bis[3,4,6-trichlorophenol], 2,2'-methylene-,2,2'-METHYLENEBIS(3,4,6-TRICHLOROPHENOL),2,2'-Methylenebis(3,5,6-trichlorophenol) 2,4,5-Trichlorophenoxyacetic acid TETRACHLOROCATECHOL