Ethyl 3-amino-4,4,4-trifluorocrotonate

CAS: 372-29-2

Ref. 3D-FE59717

Product Information

• Name: Ethyl 3-amino-4,4,4-trifluorocrotonate
• Synonyms: Ethyl 3-amino-4,4,4-trifluoro-2-butenoate3-Amino-4,4,4-trifluorocrotonic acid ethyl ester, 2-Butenoic Acid, 3-Amino-4,4,4-Trifluoro-, Ethyl Ester, 3-Amino-4,4,4-trifluoro-2-butenoic acid ethyl ester, 3-Amino-4,4,4-trifluorocrotonic acid ethyl ester, 4,4,4-Trifluoro-3-Amino crotonic acid ethylester, Crotonic acid, 3-amino-4,4,4-trifluoro-, ethyl ester, Ethyl 3-Amino-4,4,4-Trifluro Crotonate, Ethyl 3-amino-4,4,4-trifluoro-2-butenoate, Ethyl 3-amino-4,4,4-trifluorobut-2-enoate, Ethyl 4,4,4-Trifluoro-3-Hydroxybutanoate, ethyl (2Z)-3-amino-4,4,4-trifluorobut-2-enoate, ethyl (3E)-4,4,4-trifluoro-3-iminobutanoate

Description

Ethyl 3-amino-4,4,4-trifluorocrotonate is a prodrug that is metabolized by hydrolysis to the active drug ethyl trifluoroacetate. It can be used to treat disorders of the intestine such as ulcerative colitis and Crohn's disease. This prodrug has been shown to be more stable in acidic environments than other esters of trifluoroacetic acid. The drug is also used for synthesis of various pharmaceuticals. An operational profile for this drug has been developed using intestinal fluid from pigs and humans. Synthetic methods for this compound have been developed that use isopropyl alcohol as a solvent or solventless methods with ammonium sulfate as a solvent.

• Brand: Biosynth

Chemical properties

• Molecular weight: 183.13 g/mol
• Formula: C₆H₈F₃NO₂
• Purity: Min. 95%
• InChI: InChI=1S/C6H8F3NO2/c1-2-12-5(11)3-4(10)6(7,8)9/h3H,2,10H2,1H3/b4-3-
• InChI key: InChIKey=NXVKRKUGIINGHD-ARJAWSKDSA-N
• SMILES: CCOC(=O)/C=C(\N)C(F)(F)F