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625-24-1

625-24-1 Structure

625-24-1 Structure
IdentificationBack Directory
[Name]

2,2,2-TRICHLOROETHYL ACETATE
[CAS]

625-24-1
[Synonyms]

2,2,2-TRICHLOROETHYL ACETATE
2,2,2-trichloroethyl ethanoate
Ethanol, 2,2,2-trichloro-, 1-acetate
[Molecular Formula]

C4H5Cl3O2
[MDL Number]

MFCD00142742
[MOL File]

625-24-1.mol
[Molecular Weight]

191.44
Chemical PropertiesBack Directory
[Boiling point ]

62 °C(Press: 13 Torr)
[density ]

1.401 g/mL at 20 °C (lit.)
[refractive index ]

n20/D 1.457
[BRN ]

1757888
[InChI]

1S/C4H5Cl3O2/c1-3(8)9-2-4(5,6)7/h2H2,1H3
[InChIKey]

XHAXVDWUMCHTCY-UHFFFAOYSA-N
[SMILES]

CC(=O)OCC(Cl)(Cl)Cl
Safety DataBack Directory
[Hazard Codes ]

T
[Risk Statements ]

23/24/25
[Safety Statements ]

36/37/39-45
[WGK Germany ]

3
[RTECS ]

AJ8300000
[F ]

10-21
[Storage Class]

10 - Combustible liquids
[Hazard Classifications]

Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Hazard InformationBack Directory
[Uses]

2,2,2-Trichloroethyl acetate may be used in the enzyme catalyzed synthesis of enantiomerically pure prostaglandin intermediate, (1S,4R)-(-)-4-hydroxy-2-cyclopentenyl acetate.
[Synthesis Reference(s)]

Journal of the American Chemical Society, 75, p. 3020, 1953 DOI: 10.1021/ja01108a506
[General Description]

2,2,2-Trichloroethyl acetate is used as acetyl donor in anhydrous, enzyme-catalyzed enantioselective acetylations.
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