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Basic Information
CAS No.: 933-75-5
Name: 2,3,6-TRICHLOROPHENOL
Molecular Structure:
Molecular Structure of 933-75-5 (2,3,6-TRICHLOROPHENOL)
Formula: C6H3 Cl3 O
Molecular Weight: 197.448
Synonyms: 2,3,6-Trichlorophenol
EINECS: 213-271-7
Density: 1.596 g/cm3
Melting Point: 53-55 °C(lit.)
Boiling Point: 230.6 °C at 760 mmHg
Flash Point: 93.3 °C
Solubility: methanol: 0.1 g/mL, clear
Appearance: off-white, light tan to purple crystals
Hazard Symbols: HarmfulXn
Risk Codes: 22-36/38
Safety: Poison by intraperitoneal route. Mutation data reported. When heated to decomposition it emits toxic fumes of Cl. See also CHLOROPHENOLS.
Transport Information: UN 2020 6
PSA: 20.23000
LogP: 3.35240
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Chemistry

IUPAC Name: 2,3,6-Trichlorophenol 
Molecular Formula: C6H3Cl3O
Molecular Weight: 197.44g/mol
EINECS: 213-271-7
Transport Information: UN 2020 6
Density:1.596 g/cm3
Melting Point: 53-55 °C(lit.)
Boiling Point: 230.6 °C at 760 mmHg
Flash Point: 93.3 °C
Solubility: :0.1 g/mL in methanol, clear
Appearance: off-white, light tan to purple crystals
Stability: Combustible. Incompatible with strong oxidizing agents,acid anhydrides, acid chlorides. May be hygroscopic.
Freely Rotating Bonds: 1
Polar Surface Area: 9.23 Å2
Index of Refraction: 1.608
Molar Refractivity: 42.81 cm3
Molar Volume: 123.7 cm3
Polarizability: 16.97 ×10-24 cm3
Surface Tension: 50.5 dyne/cm 
Enthalpy of Vaporization: 48.63 kJ/mol
Vapour Pressure: 0.043 mmHg at 25°C 
The Cas Register Number  of 2,3,6-Trichlorophenol is 933-75-5.The chemical synonyms of 2,3,6-Trichlorophenol (CAS NO.933-75-5) are 2,3,6-Trichloro-Pheno ; Phenol, 2,3,6-Trichloro- ; 2,3,6-Trichlorophenol ; 2,3,6-Trichlorophenol Pestanal, 250 Mg ;  2,3,6-Trichlorophenol, 100mg, Neat ; 2,3,6-Trichlorophenol,98%  ; Trichlorophenol, 2,3,6- .Product categories of 2,3,6-Trichlorophenol (CAS NO.933-75-5) are Pesticides&Metabolites ; Q-ZAlphabetic ; Alpha Sort;Chemical Class ; ChloroAnalytical Standards ; Halogenated ; PhenolsVolatiles/ Semivolatiles ; TP - TZ ; T-ZAlphabetic  .The molecular structure of 2,3,6-Trichlorophenol (CAS NO.933-75-5) is .

Uses

  It can be used in organic synthesis.

Toxicity Data With Reference

1.    

mmo-sat 10 µg/plate

    TECSDY    Toxicological and Environmental Chemistry. 14 (1987),143.
2.    

cyt-ham:lng 200 mg/L

    MUREAV    Mutation Research. 241 (1990),175.
3.    

ipr-rat LD50:308 mg/kg

    BJPCAL    British Journal of Pharmacology and Chemotherapy. 13 (1958),20.

 

Consensus Reports

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

Safety Profile

Poison by intraperitoneal route. Mutation data reported. When heated to decomposition it emits toxic fumes of Cl. See also CHLOROPHENOLS.
Hazard Codes: HarmfulXn
Risk Statements: 22-36/38 
R22: Harmful if swallowed. 
R36/38: Irritating to eyes and skin.
Safety Statements: 26-28 
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. 
S28: After contact with skin, wash immediately with plenty of soap-suds.
HazardClass: 6.1(b)