10879

1,1,3-Trichloroacetone

produced by Wacker Chemie AG, Burghausen, Germany, ≥86.5% (GC)

• Synonym(s): TCA, 1,1,3-Trichloro-2-propanone
• Linear Formula: (Cl)₂CHCOCH₂Cl
• CAS Number: 921-03-9
• Molecular Weight: 161.41
• Beilstein: 1746647
• MDL number: MFCD00040500
• UNSPSC Code: 12352100
• PubChem Substance ID: 57646825
• NACRES: NA.22

Properties

• grade: produced by Wacker Chemie AG, Burghausen, Germany
• Quality Level: 100
• Assay: ≥86.5% (GC)
• bp: 88-90 °C/76 mmHg (lit.)
• mp: 9-11 °C (lit.)
• density: 1.512 g/mL at 20 °C (lit.)
• SMILES string: ClCC(=O)C(Cl)Cl
• InChI: 1S/C3H3Cl3O/c4-1-2(7)3(5)6/h3H,1H2
• InChI key: ZWILTCXCTVMANU-UHFFFAOYSA-N

Description

General description

1,1,3-Trichloroacetone is direct-acting mutagens in the Ames/Salmonella assay. It is precursor for the generation of 1,3-dihalo oxyallyl intermediates, which undergo [4 + 3] cycloadditions with a host of 1,3-diene systems.

Application

1,1,3-Trichloroacetone was used in base-induced solvolyses of [3.2.1]Bicyclic α,α′-dichloro ketones.

Other Notes

prices for bulk quantities on request

Safety Information

• Pictograms: GHS05,GHS06,GHS09
• Signal Word: Danger
• Hazard Statements: H301 + H311 - H314 - H330 - H410
• Precautionary Statements: P273 - P280 - P301 + P310 + P330 - P303 + P361 + P353 - P304 + P340 + P310 - P305 + P351 + P338 + P310
• Hazard Classifications: Acute Tox. 1 Inhalation - Acute Tox. 3 Dermal - Acute Tox. 3 Oral - Aquatic Acute 1 - Aquatic Chronic 1 - Eye Dam. 1 - Skin Corr. 1B
• Storage Class Code: 6.1B - Non-combustible, acute toxic Cat. 1 and 2 / very toxic hazardous materials
• WGK: WGK 3
• Flash Point(F): 174.2 °F - closed cup
• Flash Point(C): 79 °C - closed cup
• Personal Protective Equipment: dust mask type N95 (US), Eyeshields, Gloves