Ethyl bromodifluoroacetate

Ethyl bromodifluoroacetate is an ester with the chemical formula F2BrCH−CO2CH2CH3. It can be used to introduce the CF2 group when synthesising chemical compounds. It is a colorless to yellow liquid. It is an ethyl ester of bromodifluoroacetic acid.

Ethyl bromodifluoroacetate
Names
IUPAC name
Ethyl 2-bromo-2,2-difluoroacetate
Systematic IUPAC name
Ethyl 2,2-dibromo-2-fluoro-acetate
Other names
Difluorobromoacetic acid ethyl ester
Identifiers
3D model (JSmol)
ChemSpider
ECHA InfoCard 100.010.517
EC Number
  • 211-567-0
PubChem CID
UNII
  • InChI=1S/C4H5BrF2O2/c1-2-9-3(8)4(5,6)7/h2H2,1H3
    Key: IRSJDVYTJUCXRV-UHFFFAOYSA-N
  • InChI=1/C4H5Br2FO2/c1-2-9-3(8)4(5,6)7/h2H2,1H3
SMILES
  • BrC(Br)(F)C(=O)OCC
Properties
F2BrCHCO2CH2CH3
Molar mass 202.983 g·mol−1
Appearance Colorless to slightly yellow liquid
Density 1.583 g/mL
Boiling point 82 °C (180 °F; 355 K) pressure is at 33 torr
Vapor pressure 1.36 mmHg at 25°C
Hazards
GHS labelling:
Danger
H225, H314
P210, P233, P240, P241, P242, P243, P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P370+P378, P403+P235, P405, P501
Except where otherwise noted, data are given for materials in their standard state (at 25 °C [77 °F], 100 kPa).
Infobox references
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